9(S)-hydroxy-(10E,12Z,15Z)-octadeca-10,12,15-trienoate

Chemical Formula:

C₁₈H₂₉O₃

Molecular Weight:

293.425 Daltons

Monoisotopic Mass:

294.2194948293 Daltons

SMILES:

CCC=CCC=CC=CC(CCCCCCCC([O-])=O)O

InChI:

1S/C18H30O3/c1-2-3-4-5-6-8-11-14-17(19)15-12-9-7-10-13-16-18(20)21/h3-4,6,8,11,14,17,19H,2,5,7,9-10,12-13,15-16H2,1H3,(H,20,21)/p-1/b4-3-,8-6-,14-11+/t17-/m1/s1

InChIKey:

RIGGEAZDTKMXSI-MEBVTJQTSA-M

Databases

MetaCyc: CPD-17614

RefMet: 9S-HOTrE

PubChem (CID): 91820443 6439873

Seed: cpd15042

ChEBI: 80447

MetaNetX: MNXM723544

KEGG: C16326