ent-7α-hydroxykaur-16-en-19-oate

Chemical Formula:

C₂₀H₂₉O₃

Molecular Weight:

317.447 Daltons

Monoisotopic Mass:

318.2194948293 Daltons

SMILES:

C=C1(C4(CC[CH]3(C(C1)(C(O)C[CH]2(C(C([O-])=O)(C)CCCC(C)23))C4)))

InChI:

1S/C20H30O3/c1-12-10-20-11-13(12)5-6-14(20)18(2)7-4-8-19(3,17(22)23)15(18)9-16(20)21/h13-16,21H,1,4-11H2,2-3H3,(H,22,23)/p-1/t13-,14+,15+,16+,18+,19-,20+/m1/s1

InChIKey:

KMLXVEXJZSTMBV-YDIYEOSVSA-M

Synonyms

ent-7-α-hydroxykaurenoate
ent-7-α-hydroxykaurenoic acid
7-hydroxy-kaurenoic acid

Databases

MetaCyc: CPD1F-136

ChEBI: 57298

LIPID MAPS: LMPR0104540005

PubChem (CID): 25200352

KEGG: C11875

Seed: cpd08673

MetaNetX: MNXM1825