phaseic acid

Chemical Formula:

C₁₅H₁₉O₅

Molecular Weight:

279.312 Daltons

Monoisotopic Mass:

280.1310737525 Daltons

SMILES:

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

InChI:

1S/C15H20O5/c1-10(6-12(17)18)4-5-15(19)13(2)7-11(16)8-14(15,3)20-9-13/h4-6,19H,7-9H2,1-3H3,(H,17,18)/p-1/b5-4+,10-6-/t13?,14-,15-/m0/s1

InChIKey:

IZGYIFFQBZWOLJ-OFWWUEPESA-M

Synonyms

Databases

MetaCyc: CPD-7725

ChEBI: 28205 62069

PubChem (CID): 25244821 138319106

KEGG: C09707

Seed: cpd06600

MetaNetX: MNXM5889