Icosanoic Acid
fo-8dc69b8c345d387f
Identity
- Type
- Neutral molecule
- CAS
- 506-30-9
- EC
- 208-031-3
- Origin
- EF 3.1 hybrid_name_cas_v1
- Changes
- 56 across every transformer
Structure
Alternative labels
11- arachic acid
- Arachidic acid
- arachidinic acid
- Arachinsaeure
- C20 fatty acid
- C20:0
- CH3-[CH2]18-COOH
- eicosanoic acid
- n-Eicosanic acid
- n-eicosanoic acid
- Peanut acid
Properties
| Property | Value |
|---|---|
| Elemental charge chemrof:elemental_charge | 0 |
| InChI2D key string chemrof:inchi2d_key_string | VKOBVWXKNCXXDE-UHFFFAOYSA-N |
| InChI2D string chemrof:inchi2d_string | InChI=1S/C20H40O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(21)22/h2-19H2,1H3,(H,21,22) |
| IUPAC name chemrof:IUPAC_name | Icosanoic Acid |
| Molecular formula chemrof:molecular_formula | C20H40O2 |
| Molecular mass chemrof:molecular_mass | 312.538 |
| Monoisotopic mass chemrof:monoisotopic_mass | 312.30283, 312.302831 |
| SMILES string chemrof:smiles_string | CCCCCCCCCCCCCCCCCCCC(=O)O |
Known URLs
30Where 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=506-30-9 | enrich_references.chebi_xrefs |
| ChEBI | https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:28822 | enrich_references.chebi_id_link |
| chem.echa.europa.eu | https://chem.echa.europa.eu/100.007.302 | enrich_references.pubchem_identifier_url |
| comptox.epa.gov | https://comptox.epa.gov/dashboard/DTXSID1060134 | enrich_references.pubchem_identifier_url |
| dtp.cancer.gov | https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=93983 | enrich_references.pubchem_identifier_url |
| ebi.ac.uk | https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL1173381 | enrich_references.pubchem_identifier_url |
| gmelin | gmelin:854866 | enrich_references.chebi_xrefs |
| gsrs.ncats.nih.gov | https://gsrs.ncats.nih.gov/ginas/app/beta/substances/PQB8MJD4RB | enrich_references.pubchem_identifier_url |
| HMDB | https://hmdb.ca/metabolites/HMDB0002212 | enrich_references.chebi_xrefs |
| jglobal.jst.go.jp | http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J2.607G | enrich_references.pubchem_identifier_url |
| KEGG | https://www.genome.jp/entry/C06425 | enrich_references.chebi_xrefs |
| kegg.jp | https://www.kegg.jp/entry/C06425 | enrich_references.pubchem_identifier_url |
| knapsack | knapsack:C00001209 | enrich_references.chebi_xrefs |
| LIPID MAPS | https://www.lipidmaps.org/databases/lmsd/LMFA01010020 | enrich_references.chebi_xrefs |
| lipidmaps.org | https://lipidmaps.org/databases/lmsd/LMFA01010020 | enrich_references.pubchem_identifier_url |
| metabolomicsworkbench.org | https://www.metabolomicsworkbench.org/data/StructureData.php?RegNo=41 | enrich_references.pubchem_identifier_url |
| MetaCyc | https://metacyc.org/compound?orgid=META&id=ARACHIDIC_ACID | enrich_references.chebi_xrefs |
| ncithesaurus.nci.nih.gov | https://ncithesaurus.nci.nih.gov/ncitbrowser/ConceptReport.jsp?dictionary=NCI_Thesaurus&ns=ncit&code=C68321 | enrich_references.pubchem_identifier_url |
| patent | patent:CN102352348 | enrich_references.chebi_xrefs |
| patent | patent:WO2013000382 | enrich_references.chebi_xrefs |
| pdb-ccd | pdb-ccd:DCR | enrich_references.chebi_xrefs |
| PubChem | https://pubchem.ncbi.nlm.nih.gov/compound/10467 | enrich_references.pubchem_compound |
| PubChem | https://pubchem.ncbi.nlm.nih.gov/substance/?source=niaid&sourceid=017615 | enrich_references.pubchem_identifier_url |
| PubMed | https://pubmed.ncbi.nlm.nih.gov/17279692 | enrich_references.chebi_xrefs |
| PubMed | https://pubmed.ncbi.nlm.nih.gov/18036601 | enrich_references.chebi_xrefs |
| PubMed | https://pubmed.ncbi.nlm.nih.gov/19908738 | enrich_references.chebi_xrefs |
| reaxys | reaxys:1788211 | enrich_references.chebi_xrefs |
| rxnav.nlm.nih.gov | https://rxnav.nlm.nih.gov/id/rxnorm/1716331 | enrich_references.pubchem_identifier_url |
| Wikidata | https://www.wikidata.org/wiki/Q409608 | enrich_references.pubchem_identifier_url |
| Wikipedia | https://en.wikipedia.org/wiki/Arachidic_acid | enrich_references.chebi_xrefs |
Elementary flows
13| Flow | Context | Source | Unit | CFs |
|---|---|---|---|---|
| 07bed52a-9625-46bf-aec8-9c5a16abc52b | Environmental → Air → Aircraft cruise height | EF 3.1 | kg | 2 |
| a452d943-00a3-49c9-bebe-8e5579145719 | Environmental → Air → Ground level → Urban (>1000 people/square mile) | EF 3.1 | kg | 2 |
| a8e2b05d-6426-409e-a6c8-0e7f52807c6b | Environmental → Air → Indoor | EF 3.1 | kg | 2 |
| dddb144e-1b80-497d-849d-b8cb4ff31680 | Environmental → Air → Long-term | EF 3.1 | kg | 0 |
| 6032eb0b-f0a6-45e9-a87c-0aa93034c6cd | Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) | EF 3.1 | kg | 2 |
| b8fc241e-a3f2-4360-8092-d1eec9773b73 | Environmental → Air → Unknown | EF 3.1 | kg | 2 |
| 5655ea14-2d16-4ed5-8af0-a2281c330c01 | Environmental → Ground → Agricultural | EF 3.1 | kg | 2 |
| 9695355c-7316-4715-8221-378278a891c1 | Environmental → Ground → Non-agricultural | EF 3.1 | kg | 2 |
| 092f4bdb-a8c8-4b81-9d94-fc633a5afd55 | Environmental → Ground → Unknown | EF 3.1 | kg | 2 |
| 536a1aba-e079-4eab-b63b-0c979787c3a1 | Environmental → Water → Long-term | EF 3.1 | kg | 0 |
| 3048eef0-33eb-4bc7-a435-2b3191da6b90 | Environmental → Water → Ocean | EF 3.1 | kg | 2 |
| 8910c143-e4b3-4d67-82b5-6669dc9a3fe0 | Environmental → Water → Surface water | EF 3.1 | kg | 2 |
| f5c05500-9151-4682-be4b-b60567a205a4 | Environmental → Water → Unknown | EF 3.1 | kg | 2 |
History
Everything that changed this substance (56 changes)
Full record
Flow object JSON
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Something wrong here?
- This substance is published under the wrong name
- This is not that chemical
- This record is two substances, or it is a second copy of one
You do not need to run a build or clone anything. Name the record and say what your evidence is; the measurement is done for you. How contributing works