InCHi String:
InChI=1S/C8H16O2/c1-2-3-4-5-6-7-8(9)10/h2-7H2,1H3,(H,9,10)
canonical and isomeric SMILES: CCCCCCCC(=O)O
PUBCHEM iupac NAME: PUBCHEM iupac OPENEYE NAME: PUBCHEM iupac CAS NAME: PUBCHEM iupac SYSTEMATIC NAMEoctanoic acid
PUBCHEM iupac TRADITIONAL NAMEcaprylic acid
PubChem Substance (SID):
85165284 8144270 2331PubChem Compound (CID):
379KEGG: Compound ID
D05220CAS Registry IDs: 68937-74-6 124-07-2
PDB Chemical Component
OCAMiscellaneous Databases and IDs:
Sigma-Aldrich C2875_SIGMA
ChEBI CHEBI:28837 EPA DSSTox 33803
ChemBank NCIOpen2_009358
LipidMAPS LMFA01010008
BioCyc CPD-195
ChemIDplus 068937746
SMID OCA
ChemSpider 11212653
MMDB 62679.2
EINECS 273-085-7
NCGC NCGC00090957-01
NIST Chemistry WebBook 1696520005
MMCD cq_03621
MDL MFCD00004429
Reference data were obtained primarily from the PubChem database.
Three dimensional molecular rendering uses Jmol.
