8,8a-deoxyoleandolide

Chemical Formula:

C₂₀H₃₆O₆

Molecular Weight:

372.501 Daltons

Monoisotopic Mass:

372.2511888882 Daltons

SMILES:

CC1(CC(C)C(O)C(C)C(O)C(C)C(=O)OC(C)C(C)C(O)C(C)C(=O)1)

InChI:

1S/C20H36O6/c1-9-8-10(2)17(22)13(5)19(24)14(6)20(25)26-15(7)11(3)18(23)12(4)16(9)21/h9-15,17-19,22-24H,8H2,1-7H3/t9-,10+,11+,12+,13-,14-,15-,17+,18+,19+/m1/s1

InChIKey:

OLPAVFVRSHWADO-KYEFFAPUSA-N

Databases

MetaCyc: CPD-13946

RefMet: 8,8a-Deoxyoleandolide

ChEBI: 29504

KEGG: C11989

PubChem (CID): 193898

Seed: cpd08786

MetaNetX: MNXM5584