Consensus flow list

Sulfamethoxazole

fo-a511520633b2c7ee

Identity

Type
Neutral molecule
CAS
723-46-6
EC
211-963-3
Origin
EF 3.1 hybrid_name_cas_v1
Changes
57 across every transformer

Structure

Structure diagram for Sulfamethoxazole

What it is used for

1

Roles, not types. A substance bears as many as apply — sulfluramid is an insecticide and an acaricide — and each is a class ChEBI curates, asserted with ChEBI’s own has role. The narrow ones publish the broad ones alongside them, so a substance filed as a herbicide is a pesticide here too. See agricultural chemicals for what the axis is and which classes are published.

Role Definition Evidence
environmental contaminant CHEBI:78298 Any minor or unwanted substance introduced into the environment that can have undesired effects. ChEBI

Alternative labels

21

Properties

PropertyValue
Elemental charge chemrof:elemental_charge 0
InChI2D key string chemrof:inchi2d_key_string JLKIGFTWXXRPMT-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/C10H11N3O3S/c1-7-6-10(12-16-7)13-17(14,15)9-4-2-8(11)3-5-9/h2-6H,11H2,1H3,(H,12,13)
IUPAC name chemrof:IUPAC_name 3-(p-Aminophenylsulfonamido)-5-methylisoxazole
Molecular formula chemrof:molecular_formula C10H11N3O3S
Molecular mass chemrof:molecular_mass 253.283
Monoisotopic mass chemrof:monoisotopic_mass 253.05211, 253.052112
SMILES string chemrof:smiles_string Cc1cc(NS(=O)(=O)c2ccc(N)cc2)no1

Known URLs

70

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=144930-01-8 enrich_references.pubchem_identifier_url
CAS Common Chemistry https://commonchemistry.cas.org/detail?cas_rn=144993-89-5 enrich_references.pubchem_identifier_url
CAS Common Chemistry https://commonchemistry.cas.org/detail?cas_rn=723-46-6 enrich_references.chebi_xrefs
ChEBI https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:9332 enrich_references.chebi_id_link
chem.echa.europa.eu https://chem.echa.europa.eu/100.010.877 enrich_references.pubchem_identifier_url
chem.echa.europa.eu https://chem.echa.europa.eu/100.183.822 enrich_references.pubchem_identifier_url
comptox.epa.gov https://comptox.epa.gov/dashboard/DTXSID8026064 enrich_references.pubchem_identifier_url
DrugBank https://go.drugbank.com/drugs/DB01015 enrich_references.chebi_xrefs
drugbank.ca https://www.drugbank.ca/drugs/DB01015 enrich_references.pubchem_identifier_url
drugcentral drugcentral:2514 enrich_references.chebi_xrefs
drugcentral.org https://drugcentral.org/drugcard/2514 enrich_references.pubchem_identifier_url
dtp.cancer.gov https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=147832 enrich_references.pubchem_identifier_url
dtp.cancer.gov https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=757328 enrich_references.pubchem_identifier_url
ebi.ac.uk https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL443 enrich_references.pubchem_identifier_url
gmelin gmelin:226453 enrich_references.chebi_xrefs
gsrs.ncats.nih.gov https://gsrs.ncats.nih.gov/ginas/app/beta/substances/JE42381TNV enrich_references.pubchem_identifier_url
HMDB https://hmdb.ca/metabolites/HMDB0015150 enrich_references.chebi_xrefs
jglobal.jst.go.jp http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J4.525J enrich_references.pubchem_identifier_url
KEGG https://www.genome.jp/entry/C07315 enrich_references.chebi_xrefs
KEGG https://www.genome.jp/entry/D00447 enrich_references.chebi_xrefs
kegg.jp https://www.kegg.jp/entry/C07315 enrich_references.pubchem_identifier_url
kegg.jp https://www.kegg.jp/entry/D00447 enrich_references.pubchem_identifier_url
lincs.smallmolecule lincs.smallmolecule:LSM-5422 enrich_references.chebi_xrefs
metabolomicsworkbench.org https://www.metabolomicsworkbench.org/data/StructureData.php?RegNo=43260 enrich_references.pubchem_identifier_url
ncithesaurus.nci.nih.gov https://ncithesaurus.nci.nih.gov/ncitbrowser/ConceptReport.jsp?dictionary=NCI_Thesaurus&ns=ncit&code=C47737 enrich_references.pubchem_identifier_url
pharmgkb.org https://www.pharmgkb.org/chemical/PA451544 enrich_references.pubchem_identifier_url
platform.opentargets.org https://platform.opentargets.org/drug/CHEMBL443 enrich_references.pubchem_identifier_url
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/5329 enrich_references.pubchem_compound
PubChem https://pubchem.ncbi.nlm.nih.gov/substance/?source=niaid&sourceid=006897 enrich_references.pubchem_identifier_url
PubMed https://pubmed.ncbi.nlm.nih.gov/10843725 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/10891117 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/10969989 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/11350866 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/11431418 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/12019187 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/15497867 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/15588915 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/15967282 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/15984773 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/17095123 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/17110110 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/17158933 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/17311370 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/17442935 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/17573190 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/18334600 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/18958736 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/19436870 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/20564608 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/22534821 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/226453 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/23611245 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/23649399 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/23742687 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/25851465 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/313909 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/3906132 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/6864729 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/7486915 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/7490723 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/7534104 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/7602118 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/7731020 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/7798534 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/8208693 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/8632413 enrich_references.chebi_xrefs
reaxys reaxys:226453 enrich_references.chebi_xrefs
rxnav.nlm.nih.gov https://rxnav.nlm.nih.gov/id/rxnorm/10180 enrich_references.pubchem_identifier_url
wikidata.org https://www.wikidata.org/wiki/Q415843 enrich_references.pubchem_identifier_url
Wikipedia https://en.wikipedia.org/wiki/Sulfamethoxazole enrich_references.chebi_xrefs

Elementary flows

13
Flow Context Source Unit CFs
6f14afb4-d36d-475a-9d3c-775a52b52733 Environmental → Air → Aircraft cruise height EF 3.1 kg 4
0b3fc582-00c8-4335-a224-7a5fd624a8f9 Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 4
dde2a88e-e0c8-408c-864c-f83bfa2a3e1e Environmental → Air → Indoor EF 3.1 kg 4
8fc089b4-528d-49eb-a64d-636f8b103c1a Environmental → Air → Long-term EF 3.1 kg 0
8d351cd9-ae6b-4e0a-8368-96c669841ecf Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 4
f54c6ba6-3f76-400a-ad21-9116e29232c9 Environmental → Air → Unknown EF 3.1 kg 4
ffab15d8-5161-4412-8c0a-f1f381ecc856 Environmental → Ground → Agricultural EF 3.1 kg 4
e03cf26b-ef78-4b23-9bce-8c6cec9bd960 Environmental → Ground → Non-agricultural EF 3.1 kg 4
67a0504a-cea0-4ff5-a263-ba63c52b1863 Environmental → Ground → Unknown EF 3.1 kg 4
6c78e377-e6ea-4ec2-8aef-be8dc7e017dd Environmental → Water → Long-term EF 3.1 kg 0
372911cd-b305-4bf2-9b55-280ef93d908b Environmental → Water → Ocean EF 3.1 kg 4
9201797a-af4a-4933-a99b-48d501f64448 Environmental → Water → Surface water EF 3.1 kg 4
af8b08bd-dbfa-48e4-a5e3-53bf344ce5d2 Environmental → Water → Unknown EF 3.1 kg 4

History

Everything that changed this substance (57 changes)

Open the changes page

Full record

Flow object JSON 
{
  "flow_object_id": "fo-a511520633b2c7ee",
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  "altLabel": [
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    },
    {
      "@value": "3-Sulfanilamido-5-methylisoxazole",
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    },
    {
      "@value": "4-amino-N-(5-methyl-1,2-oxazol-3-yl)benzenesulfonamide",
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      }
    },
    {
      "@value": "4-Amino-N-(5-methyl-3-isoxazolyl)benzenesulfonamide",
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    },
    {
      "@value": "4-Amino-N-(5-methyl-3-isoxazolyl)benzensulfonamide",
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    },
    {
      "@value": "5-Methyl-3-sulfanilamidoisoxazole",
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    },
    {
      "@value": "Benzenesulfonamide, 4-amino-N-(5-methyl-3-isoxazolyl)-",
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Gantanol",
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    },
    {
      "@value": "Gantanol (TN)",
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    },
    {
      "@value": "MeSH ID: D013420",
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      }
    },
    {
      "@value": "N-(5-Methylisoxazol-3-yl)-4-aminobenzenesulfonamide",
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "N1-(5-Methyl-3-isoxazolyl)sulfanilamide",
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      "@lang": "en",
      "provenance": {
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          "EF 3.1",
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Radonil",
      "@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=723-46-6"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Ro 4-2130",
      "@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=723-46-6"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Sinomin",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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        "prov:wasAttributedTo": "consensus-flow-list",
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Sulfamethalazole",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:723-46-6",
          "EF 3.1",
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Sulfamethoxazol",
      "@language": "en",
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      "provenance": {
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Sulfanilamide, N1-(5-methyl-3-isoxazolyl)-",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
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        "prov:hadPrimarySource": [
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Sulfisomezole",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "sulphamethoxazole",
      "@language": "en",
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      "provenance": {
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  "properties": {
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      "@id": "https://w3id.org/chemrof/molecular_formula",
      "@value": [
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      "attested_by": {
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      "rdfs:label": "SMILES",
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