Consensus flow list

Identity

Type
Neutral molecule
CAS
120-72-9
EC
204-420-7
Origin
EF 3.1 hybrid_name_cas_v1
Changes
57 across every transformer

Structure

Structure diagram for Indole

Alternative labels

7

Properties

PropertyValue
Elemental charge chemrof:elemental_charge 0
InChI2D key string chemrof:inchi2d_key_string SIKJAQJRHWYJAI-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/C8H7N/c1-2-4-8-7(3-1)5-6-9-8/h1-6,9H
IUPAC name chemrof:IUPAC_name Indole
Molecular formula chemrof:molecular_formula C8H7N
Molecular mass chemrof:molecular_mass 117.151
Monoisotopic mass chemrof:monoisotopic_mass 117.057849, 117.05785
SMILES string chemrof:smiles_string c1ccc2[nH]ccc2c1

Known URLs

27

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
beilstein beilstein:107693 enrich_references.chebi_xrefs
CAS Common Chemistry https://commonchemistry.cas.org/detail?cas_rn=120-72-9 enrich_references.chebi_xrefs
CAS Common Chemistry https://commonchemistry.cas.org/detail?cas_rn=64809-15-0 enrich_references.pubchem_identifier_url
CAS Common Chemistry https://commonchemistry.cas.org/detail?cas_rn=82451-55-6 enrich_references.pubchem_identifier_url
ChEBI https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:16881 enrich_references.chebi_id_link
chem.echa.europa.eu https://chem.echa.europa.eu/100.004.019 enrich_references.pubchem_identifier_url
comptox.epa.gov https://comptox.epa.gov/dashboard/DTXSID0020737 enrich_references.pubchem_identifier_url
DrugBank https://go.drugbank.com/drugs/DB04532 enrich_references.chebi_xrefs
drugbank.ca https://www.drugbank.ca/drugs/DB04532 enrich_references.pubchem_identifier_url
dtp.cancer.gov https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=1964 enrich_references.pubchem_identifier_url
ebi.ac.uk https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL15844 enrich_references.pubchem_identifier_url
femaflavor.org https://www.femaflavor.org/flavor-library/indole enrich_references.pubchem_identifier_url
gmelin gmelin:3477 enrich_references.chebi_xrefs
gsrs.ncats.nih.gov https://gsrs.ncats.nih.gov/ginas/app/beta/substances/8724FJW4M5 enrich_references.pubchem_identifier_url
HMDB https://hmdb.ca/metabolites/HMDB0000738 enrich_references.pubchem_identifier_url
jglobal.jst.go.jp http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J2.920C enrich_references.pubchem_identifier_url
KEGG https://www.genome.jp/entry/C00463 enrich_references.chebi_xrefs
kegg.jp https://www.kegg.jp/entry/C00463 enrich_references.pubchem_identifier_url
knapsack knapsack:C00001418 enrich_references.chebi_xrefs
metabolomicsworkbench.org https://www.metabolomicsworkbench.org/data/StructureData.php?RegNo=37398 enrich_references.pubchem_identifier_url
ncithesaurus.nci.nih.gov https://ncithesaurus.nci.nih.gov/ncitbrowser/ConceptReport.jsp?dictionary=NCI_Thesaurus&ns=ncit&code=C68534 enrich_references.pubchem_identifier_url
pdb-ccd pdb-ccd:IND enrich_references.chebi_xrefs
platform.opentargets.org https://platform.opentargets.org/drug/CHEMBL15844 enrich_references.pubchem_identifier_url
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/798 enrich_references.pubchem_compound
PubChem https://pubchem.ncbi.nlm.nih.gov/substance/?source=niaid&sourceid=034424 enrich_references.pubchem_identifier_url
wikidata.org https://www.wikidata.org/wiki/Q319541 enrich_references.pubchem_identifier_url
Wikipedia https://en.wikipedia.org/wiki/Indole enrich_references.pubchem_identifier_url

Elementary flows

13
Flow Context Source Unit CFs
9fe4756c-3f7a-47cb-ae0c-302b2886c222 Environmental → Air → Aircraft cruise height EF 3.1 kg 2
c454715a-d765-4faa-a133-7755ac7bb7b3 Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 2
bb131ad8-41a9-44b5-a663-53c32099fd48 Environmental → Air → Indoor EF 3.1 kg 2
f2b7e9a5-c52e-4a8f-871e-0f15f8414a1a Environmental → Air → Long-term EF 3.1 kg 0
eb1978ee-86df-44a5-abc2-79f96150f3d2 Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 2
a5fc84ae-53b5-4ced-9a02-89c720b9899a Environmental → Air → Unknown EF 3.1 kg 2
ea90e70c-ec49-474b-8c5d-c3b43d79e6a8 Environmental → Ground → Agricultural EF 3.1 kg 2
ae274bad-187d-4daa-9dc2-f87de79fa0a6 Environmental → Ground → Non-agricultural EF 3.1 kg 2
70d183ae-6b3b-415c-9fbc-0628b493704e Environmental → Ground → Unknown EF 3.1 kg 2
5f8e5056-d34d-4f5a-9ba9-a47b00184e1d Environmental → Water → Long-term EF 3.1 kg 0
c4c8d73b-3380-4cd1-b342-363ce2a1f26e Environmental → Water → Ocean EF 3.1 kg 2
f5a5c1d1-9fe0-4af8-9f73-d50c840717bb Environmental → Water → Surface water EF 3.1 kg 2
841c9ba1-c352-4d51-ae37-aa60a2e4bed9 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
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