pentalenolactone

Chemical Formula:

C₁₅H₁₅O₅

Molecular Weight:

275.28 Daltons

Monoisotopic Mass:

276.0997736241 Daltons

SMILES:

CC3(C(C)C4(C=C(C([O-])=O)[CH]2(C(C1(OC1)C(=O)OC2)(C=3)4)))

InChI:

1S/C15H16O5/c1-7-4-14-10(8(7)2)3-9(12(16)17)11(14)5-19-13(18)15(14)6-20-15/h3-4,8,10-11H,5-6H2,1-2H3,(H,16,17)/p-1/t8-,10?,11+,14?,15?/m1/s1

InChIKey:

NUPNVWUYFVEAIT-QMLHWYPBSA-M

Synonyms

Databases

MetaCyc: CPD-13619

PubChem (CID): 90658936 70679025

ChEBI: 70790

Seed: cpd23963

MetaNetX: MNXM20345

KEGG: C20407