Consensus flow list

Identity

Type
NeutralMolecule
CAS
110-58-7
EC
203-780-2
Origin
EF 3.1 hybrid_name_cas_v1
Changes
57 across every transformer

Structure

Structure diagram for Pentylamine

Alternative labels

14

Properties

PropertyValue
Elemental charge chemrof:elemental_charge 0
InChI2D key string chemrof:inchi2d_key_string DPBLXKKOBLCELK-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/C5H13N/c1-2-3-4-5-6/h2-6H2,1H3
IUPAC name chemrof:IUPAC_name Pentylamine
Molecular formula chemrof:molecular_formula C5H13N
Molecular mass chemrof:molecular_mass 87.166
Monoisotopic mass chemrof:monoisotopic_mass 87.104799, 87.1048
SMILES string chemrof:smiles_string CCCCCN

Known URLs

25

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=110-58-7 enrich_references.chebi_xrefs
ChEBI https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:74848 enrich_references.chebi_id_link
chem.echa.europa.eu https://chem.echa.europa.eu/100.003.438 enrich_references.pubchem_identifier_url
chem.echa.europa.eu https://chem.echa.europa.eu/100.174.250 enrich_references.pubchem_identifier_url
chem.echa.europa.eu https://chem.echa.europa.eu/100.215.698 enrich_references.pubchem_identifier_url
comptox.epa.gov https://comptox.epa.gov/dashboard/DTXSID0021919 enrich_references.pubchem_identifier_url
DrugBank https://go.drugbank.com/drugs/DB02045 enrich_references.chebi_xrefs
drugbank.ca https://www.drugbank.ca/drugs/DB02045 enrich_references.pubchem_identifier_url
dtp.cancer.gov https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=7906 enrich_references.pubchem_identifier_url
femaflavor.org https://www.femaflavor.org/flavor-library/pentylamine enrich_references.pubchem_identifier_url
gsrs.ncats.nih.gov https://gsrs.ncats.nih.gov/ginas/app/beta/substances/E05QM3V8EF enrich_references.pubchem_identifier_url
HMDB https://hmdb.ca/metabolites/HMDB0248371 enrich_references.pubchem_identifier_url
jglobal.jst.go.jp http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J1.978J enrich_references.pubchem_identifier_url
metabolomicsworkbench.org https://www.metabolomicsworkbench.org/data/StructureData.php?RegNo=146656 enrich_references.pubchem_identifier_url
patent patent:CN101619025 enrich_references.chebi_xrefs
pdb-ccd pdb-ccd:AML enrich_references.chebi_xrefs
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/8060 enrich_references.pubchem_compound
PubChem https://pubchem.ncbi.nlm.nih.gov/erg/#1106 enrich_references.pubchem_identifier_url
PubMed https://pubmed.ncbi.nlm.nih.gov/31998587 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/36202886 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/6106950 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/6136581 enrich_references.chebi_xrefs
reaxys reaxys:505953 enrich_references.chebi_xrefs
wikidata.org https://www.wikidata.org/wiki/Q766883 enrich_references.pubchem_identifier_url
Wikipedia https://en.wikipedia.org/wiki/Pentylamine enrich_references.chebi_xrefs

Elementary flows

13
Flow Context Source Unit CFs
1951cf27-8335-466c-813f-2cb874320a8c Environmental → Air → Aircraft cruise height EF 3.1 kg 2
2dbed4ea-083f-4568-b536-967c83210fe6 Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 2
d9ae5b0f-708b-456c-ae2c-2f07f39055a0 Environmental → Air → Indoor EF 3.1 kg 2
1d1ab704-dccd-4434-8a68-8efd677b89bb Environmental → Air → Long-term EF 3.1 kg 0
4b830025-51a2-49bc-812c-afb3b1f8cf55 Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 2
e452db45-8dd6-44c3-845a-a654c0c32ddc Environmental → Air → Unknown EF 3.1 kg 2
0037175a-fd8e-4428-b239-88278b6c02b2 Environmental → Ground → Agricultural EF 3.1 kg 2
80cd6bf0-0c8b-473d-a955-ebbabb620ad0 Environmental → Ground → Non-agricultural EF 3.1 kg 2
8734f059-6b34-4cdb-bec1-1eb2e99c3e35 Environmental → Ground → Unknown EF 3.1 kg 2
93c68921-1f61-4e64-925d-cc9c28850284 Environmental → Water → Long-term EF 3.1 kg 0
eb2d0a66-2f93-4a7e-a4ee-ffe7275e474a Environmental → Water → Ocean EF 3.1 kg 2
08807ca9-4c19-4331-ac60-95431cb28f78 Environmental → Water → Surface water EF 3.1 kg 2
331fa258-d449-48cb-b373-513da594d8ed Environmental → Water → Unknown EF 3.1 kg 2

History

Everything that changed this substance (57 changes)

Open the changes page

Full record

Flow object JSON
{
  "flow_object_id": "fo-f982af0f6ea6c44a",
  "prefLabel": [
    {
      "@value": "Pentylamine",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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          "EF 3.1"
        ],
        "prov:wasDerivedFrom": "legacy name field"
      }
    }
  ],
  "altLabel": [
    {
      "@value": "1-aminopentane",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "chebi_altlabels",
        "prov:wasAttributedTo": "consensus-flow-list",
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          "http://purl.obolibrary.org/obo/CHEBI_74848"
        ],
        "prov:wasDerivedFrom": "chebi synonym match"
      }
    },
    {
      "@value": "1-pentanamine",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "chebi_altlabels",
        "prov:wasAttributedTo": "consensus-flow-list",
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          "http://purl.obolibrary.org/obo/CHEBI_74848"
        ],
        "prov:wasDerivedFrom": "chebi synonym match"
      }
    },
    {
      "@value": "1-pentylamine",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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        ],
        "prov:wasDerivedFrom": "chebi synonym match"
      }
    },
    {
      "@value": "Amylamine",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "CH3(CH2)4NH2",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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        "prov:wasDerivedFrom": "chebi synonym match"
      }
    },
    {
      "@value": "Me(CH2)4NH2",
      "@language": "en",
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    },
    {
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    },
    {
      "@value": "Monopentylamine",
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        "prov:wasDerivedFrom": "common chemistry CAS lookup"
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    },
    {
      "@value": "n-AmNH2",
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      "provenance": {
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    {
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    },
    {
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