Consensus flow list

Identity

Type
Neutral molecule
CAS
79-14-1
EC
201-180-5
Origin
EF 3.1 hybrid_name_cas_v1
Changes
58 across every transformer

Structure

Structure diagram for Glycolic acid

Alternative labels

15

Properties

PropertyValue
Elemental charge chemrof:elemental_charge 0
InChI2D key string chemrof:inchi2d_key_string AEMRFAOFKBGASW-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/C2H4O3/c3-1-2(4)5/h3H,1H2,(H,4,5)
IUPAC name chemrof:IUPAC_name Glycolic acid
Molecular formula chemrof:molecular_formula C2H4O3
Molecular mass chemrof:molecular_mass 76.051
Monoisotopic mass chemrof:monoisotopic_mass 76.01604, 76.016044
SMILES string chemrof:smiles_string O=C(O)CO

Known URLs

42

Where else this substance is described. Collected while the pipeline resolved it — from ChEBI's cross-references, from PubChem's identifier list, and from the CAS number — so a link here is a record the merge actually read, not a search it suggests.

Resource URL Recorded by
CAS Common Chemistry https://commonchemistry.cas.org/detail?cas_rn=26124-68-5 enrich_references.pubchem_identifier_url
CAS Common Chemistry https://commonchemistry.cas.org/detail?cas_rn=79-14-1 enrich_references.chebi_xrefs
ChEBI https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:17497 enrich_references.chebi_id_link
chem.echa.europa.eu https://chem.echa.europa.eu/100.001.073 enrich_references.pubchem_identifier_url
chemicalsafety.ilo.org https://chemicalsafety.ilo.org/dyn/icsc/showcard.display?p_card_id=1537 enrich_references.pubchem_identifier_url
comptox.epa.gov https://comptox.epa.gov/dashboard/DTXSID0025363 enrich_references.pubchem_identifier_url
drugbank.ca https://www.drugbank.ca/drugs/DB03085 enrich_references.pubchem_identifier_url
drugcentral drugcentral:4645 enrich_references.chebi_xrefs
drugcentral.org https://drugcentral.org/drugcard/4645 enrich_references.pubchem_identifier_url
dtp.cancer.gov https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=166 enrich_references.pubchem_identifier_url
ebi.ac.uk https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL252557 enrich_references.pubchem_identifier_url
gsrs.ncats.nih.gov https://gsrs.ncats.nih.gov/ginas/app/beta/substances/0WT12SX38S enrich_references.pubchem_identifier_url
HMDB https://hmdb.ca/metabolites/HMDB0000115 enrich_references.chebi_xrefs
jglobal.jst.go.jp http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J1.494J enrich_references.pubchem_identifier_url
KEGG https://www.genome.jp/entry/C00160 enrich_references.chebi_xrefs
kegg.jp https://www.kegg.jp/entry/C00160 enrich_references.pubchem_identifier_url
kegg.jp https://www.kegg.jp/entry/C03547 enrich_references.pubchem_identifier_url
knapsack knapsack:C00007461 enrich_references.chebi_xrefs
LIPID MAPS https://www.lipidmaps.org/databases/lmsd/LMFA01050148 enrich_references.chebi_xrefs
metabolomicsworkbench.org https://www.metabolomicsworkbench.org/data/StructureData.php?RegNo=37080 enrich_references.pubchem_identifier_url
MetaCyc https://metacyc.org/compound?orgid=META&id=GLYCOLLATE enrich_references.chebi_xrefs
ncithesaurus.nci.nih.gov https://ncithesaurus.nci.nih.gov/ncitbrowser/ConceptReport.jsp?dictionary=NCI_Thesaurus&ns=ncit&code=C83737 enrich_references.pubchem_identifier_url
pdb-ccd pdb-ccd:GOA enrich_references.chebi_xrefs
platform.opentargets.org https://platform.opentargets.org/drug/CHEMBL252557 enrich_references.pubchem_identifier_url
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/757 enrich_references.pubchem_compound
PubChem https://pubchem.ncbi.nlm.nih.gov/erg/#3261 enrich_references.pubchem_identifier_url
PubChem https://pubchem.ncbi.nlm.nih.gov/substance/?source=niaid&sourceid=059757 enrich_references.pubchem_identifier_url
PubMed https://pubmed.ncbi.nlm.nih.gov/14585457 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/15662707 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/15716481 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/15716482 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/18498500 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/19025792 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/21950544 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/22044748 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/22128110 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/22360337 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/22421647 enrich_references.chebi_xrefs
reaxys reaxys:1209322 enrich_references.chebi_xrefs
rxnav.nlm.nih.gov https://rxnav.nlm.nih.gov/id/rxnorm/587318 enrich_references.pubchem_identifier_url
wikidata.org https://www.wikidata.org/wiki/Q409373 enrich_references.pubchem_identifier_url
Wikipedia https://en.wikipedia.org/wiki/Glycolic_acid enrich_references.chebi_xrefs

Elementary flows

13
Flow Context Source Unit CFs
32c17227-f17c-4d71-abe9-ce61ba694004 Environmental → Air → Aircraft cruise height EF 3.1 kg 2
d0a5fd4e-f918-493a-849c-948288978266 Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 2
a3cc8feb-f295-4ebe-89e4-7169906f3f3b Environmental → Air → Indoor EF 3.1 kg 2
3f8e4023-77bc-4723-8ae8-0db12b5fa7ec Environmental → Air → Long-term EF 3.1 kg 0
88c1d877-957b-46b3-b971-30f3f5a75cf3 Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 2
9e194948-9c0f-4543-a891-fc0e3fedf267 Environmental → Air → Unknown EF 3.1 kg 2
e8679575-7b88-4752-80de-c7d4740ea7ab Environmental → Ground → Agricultural EF 3.1 kg 2
644544af-29e9-4362-854a-4bd0071b7c3e Environmental → Ground → Non-agricultural EF 3.1 kg 2
1155eae8-1dc2-4eb4-9770-bb9fed1a04c4 Environmental → Ground → Unknown EF 3.1 kg 2
0974ed33-7230-41ba-a8f0-a18a57dd9fd2 Environmental → Water → Long-term EF 3.1 kg 0
3f161df2-0926-4062-b024-21d724fd8f84 Environmental → Water → Ocean EF 3.1 kg 2
24c8af2d-a053-4675-8f97-1533c5d328d5 Environmental → Water → Surface water EF 3.1 kg 2
b8ac955a-6b4d-4826-95b7-b46ea3ee29e0 Environmental → Water → Unknown EF 3.1 kg 2

History

Everything that changed this substance (58 changes)

Open the changes page

Full record

Flow object JSON
{
  "flow_object_id": "fo-6885ec4a1c3026f2",
  "prefLabel": [
    {
      "@value": "Glycolic acid",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:79-14-1",
          "EF 3.1"
        ],
        "prov:wasDerivedFrom": "Common Chemistry / ChEBI primary name agreement"
      }
    }
  ],
  "altLabel": [
    {
      "@value": "2-Hydroxyacetic acid",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "chebi_altlabels",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "EF 3.1",
          "http://purl.obolibrary.org/obo/CHEBI_17497"
        ],
        "prov:wasDerivedFrom": "chebi synonym match"
      }
    },
    {
      "@value": "2-hydroxyethanoic Acid",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "EF 3.1"
        ],
        "prov:wasDerivedFrom": "original name retained as altLabel"
      }
    },
    {
      "@value": "Acetic acid, 2-hydroxy-",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:79-14-1",
          "EF 3.1",
          "https://commonchemistry.cas.org/detail?cas_rn=79-14-1"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Acetic acid, hydroxy-",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:79-14-1",
          "EF 3.1",
          "https://commonchemistry.cas.org/detail?cas_rn=79-14-1"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "alpha-Hydroxyacetic acid",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "chebi_altlabels",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "EF 3.1",
          "http://purl.obolibrary.org/obo/CHEBI_17497"
        ],
        "prov:wasDerivedFrom": "chebi synonym match"
      }
    },
    {
      "@value": "Glycocide",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
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          "https://commonchemistry.cas.org/detail?cas_rn=79-14-1"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Glycollic acid",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "chebi_altlabels",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "EF 3.1",
          "http://purl.obolibrary.org/obo/CHEBI_17497"
        ],
        "prov:wasDerivedFrom": "chebi synonym match"
      }
    },
    {
      "@value": "GlyPure",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
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          "EF 3.1",
          "https://commonchemistry.cas.org/detail?cas_rn=79-14-1"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "GlyPure 70",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
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          "EF 3.1",
          "https://commonchemistry.cas.org/detail?cas_rn=79-14-1"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "GlyPure 99",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:79-14-1",
          "EF 3.1",
          "https://commonchemistry.cas.org/detail?cas_rn=79-14-1"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "HOCH2COOH",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "chebi_altlabels",
        "prov:wasAttributedTo": "consensus-flow-list",
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        ],
        "prov:wasDerivedFrom": "chebi synonym match"
      }
    },
    {
      "@value": "Hydroxyacetic acid",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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        "prov:wasAttributedTo": "consensus-flow-list",
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          "http://purl.obolibrary.org/obo/CHEBI_17497"
        ],
        "prov:wasDerivedFrom": "chebi synonym match"
      }
    },
    {
      "@value": "Hydroxyethanoic acid",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "chebi_altlabels",
        "prov:wasAttributedTo": "consensus-flow-list",
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        ],
        "prov:wasDerivedFrom": "chebi synonym match"
      }
    },
    {
      "@value": "YST-GCS",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
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          "https://commonchemistry.cas.org/detail?cas_rn=79-14-1"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "α-Hydroxyacetic acid",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    }
  ],
  "properties": {
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      "@id": "https://w3id.org/chemrof/molecular_formula",
      "@value": [
        "C2H4O3"
      ],
      "attested_by": {
        "C2H4O3": [
          "enrich_references.chebi_semantic",
          "enrich_references.pubchem_semantic",
          "rdkit_post_consensus"
        ]
      },
      "rdfs:label": "Molecular formula",
      "provenance": [
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        },
        {
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          ],
          "prov:wasDerivedFrom": "pubchem.props.Molecular Formula"
        },
        {
          "prov:wasGeneratedBy": "rdkit_post_consensus",
          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
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      ]
    },
    "https://w3id.org/chemrof/smiles_string": {
      "@id": "https://w3id.org/chemrof/smiles_string",
      "rdfs:label": "SMILES",
      "@value": [
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      ],
      "provenance": [
        {
          "prov:wasGeneratedBy": "opsin_iupac",
          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
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          ]
        },
        {
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      ],
      "attested_by": {
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    },
    "https://w3id.org/chemrof/inchi2d_string": {
      "@id": "https://w3id.org/chemrof/inchi2d_string",
      "rdfs:label": "InChI",
      "@value": [
        "InChI=1S/C2H4O3/c3-1-2(4)5/h3H,1H2,(H,4,5)"
      ],
      "provenance": [
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      },
      "rdfs:label": "InChIKey",
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    },
    "https://w3id.org/chemrof/molecular_mass": {
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      "@value": [
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      "attested_by": {
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      "rdfs:label": "Molecular mass",
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    },
    "https://w3id.org/chemrof/monoisotopic_mass": {
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      ],
      "attested_by": {
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    },
    "https://w3id.org/chemrof/elemental_charge": {
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      "@value": [
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      ],
      "attested_by": {
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      "rdfs:label": "Elemental charge",
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        "prov:wasDerivedFrom": "chebi.basic_property_values.charge"
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    },
    "https://w3id.org/chemrof/IUPAC_name": {
      "@id": "https://w3id.org/chemrof/IUPAC_name",
      "rdfs:label": "IUPAC name",
      "@value": [
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      ],
      "provenance": {
        "prov:wasGeneratedBy": "opsin_iupac",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
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        ]
      },
      "attested_by": {
        "Glycolic acid": [
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      }
    }
  },
  "references": [
    {
      "@id": "drugcentral:4645",
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        "prov:wasDerivedFrom": "chebi.xrefs_urls"
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    },
    {
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