dihydroxyphaseic acid

Chemical Formula:

C₁₅H₂₁O₅

Molecular Weight:

281.328 Daltons

Monoisotopic Mass:

282.1467238167 Daltons

SMILES:

CC(C=CC1(C2(CC(CC1(C)OC2)O)(C))O)=CC([O-])=O

InChI:

1S/C15H22O5/c1-10(6-12(17)18)4-5-15(19)13(2)7-11(16)8-14(15,3)20-9-13/h4-6,11,16,19H,7-9H2,1-3H3,(H,17,18)/p-1/b5-4+,10-6-/t11-,13?,14-,15-/m0/s1

InChIKey:

XIVFQYWMMJWUCD-BPUMUYFLSA-M

Synonyms

Databases

MetaCyc: CPD-7726

MetaboLights: MTBLC23757

HMDB: HMDB38660

LIPID MAPS: LMPR0103050005

ChEBI: 23757

PubChem (CID): 25245414 138319162

KEGG: C15971

MetaNetX: MNXM167647