Consensus flow list

Identity

Type
Neutral molecule
CAS
77538-19-3
EC
278-717-5
Origin
EF 3.1 hybrid_name_cas_v1
Changes
53 across every transformer

Structure

Structure diagram for Docosanoic Acid, Ester With 1,2,3-propanetriol

Alternative labels

13

Properties

PropertyValue
InChI2D key string chemrof:inchi2d_key_string OKMWKBLSFKFYGZ-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/C25H50O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-25(28)29-23-24(27)22-26/h24,26-27H,2-23H2,1H3
IUPAC name chemrof:IUPAC_name 2,3-bis(oxidanyl)propyl docosanoate, 2,3-dihydroxypropyl docosanoate, behenic acid glyceryl ester, docosanoic acid 2,3-dihydroxypropyl ester
Molecular formula chemrof:molecular_formula C25H50O4
Molecular mass chemrof:molecular_mass 414.671
Monoisotopic mass chemrof:monoisotopic_mass 414.37091
SMILES string chemrof:smiles_string CCCCCCCCCCCCCCCCCCCCCC(=O)OCC(CO)O

Known URLs

12

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=77538-19-3 enrich_references.consensus_cas_link
ChEBI https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:142497 enrich_references.pubchem_identifier_url
chem.echa.europa.eu https://chem.echa.europa.eu/100.045.528 enrich_references.pubchem_identifier_url
chem.echa.europa.eu https://chem.echa.europa.eu/100.071.540 enrich_references.pubchem_identifier_url
comptox.epa.gov https://comptox.epa.gov/dashboard/DTXSID701015809 enrich_references.pubchem_identifier_url
gsrs.ncats.nih.gov https://gsrs.ncats.nih.gov/ginas/app/beta/substances/A626UU0W2A enrich_references.pubchem_identifier_url
HMDB https://hmdb.ca/metabolites/HMDB0032296 enrich_references.pubchem_identifier_url
jglobal.jst.go.jp http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J815.979C enrich_references.pubchem_identifier_url
ncithesaurus.nci.nih.gov https://ncithesaurus.nci.nih.gov/ncitbrowser/ConceptReport.jsp?dictionary=NCI_Thesaurus&ns=ncit&code=C79129 enrich_references.pubchem_identifier_url
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/5362585 enrich_references.pubchem_compound
rxnav.nlm.nih.gov https://rxnav.nlm.nih.gov/id/rxnorm/1655567 enrich_references.pubchem_identifier_url
wikidata.org https://www.wikidata.org/wiki/Q27273676 enrich_references.pubchem_identifier_url

Elementary flows

13
Flow Context Source Unit CFs
68860605-1931-4696-a248-f1eda348050e Environmental → Air → Aircraft cruise height EF 3.1 kg 4
12fc5ce5-9abe-4c7c-a18f-62e2849f89c8 Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 4
84665460-052e-4fc9-8acc-e22965bdf2cf Environmental → Air → Indoor EF 3.1 kg 4
d0adfe43-b1bc-4ca7-871c-7e94eb351a29 Environmental → Air → Long-term EF 3.1 kg 0
2eb63685-e10b-4254-b48a-2c32c0e03d5d Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 4
cca95b04-7243-4f79-bfeb-8824ffd2368b Environmental → Air → Unknown EF 3.1 kg 4
f7611299-1e6e-426e-a46f-2c566898ab67 Environmental → Ground → Agricultural EF 3.1 kg 4
b10a4c68-82a6-4471-95cb-1bcaeedcf1d3 Environmental → Ground → Non-agricultural EF 3.1 kg 4
e89f9a1f-e9a0-455e-9891-0f71544f96d4 Environmental → Ground → Unknown EF 3.1 kg 4
c4456bcf-ab3e-421a-a555-6d022ba625f4 Environmental → Water → Long-term EF 3.1 kg 0
15a1e9b1-90b7-4491-b5df-5099d1d4b98d Environmental → Water → Ocean EF 3.1 kg 4
5a2de133-c36b-44a6-83dd-19ef58e10f75 Environmental → Water → Surface water EF 3.1 kg 4
8a27b2df-4690-4f3c-ad7f-e026b6a98b09 Environmental → Water → Unknown EF 3.1 kg 4

History

Everything that changed this substance (53 changes)

Open the changes page

Full record

Flow object JSON
{
  "flow_object_id": "fo-d8b148e88170b83d",
  "prefLabel": [
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  ],
  "altLabel": [
    {
      "@value": "Compritol 888CG",
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    {
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    },
    {
      "@value": "Docosanoin",
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