deoxyadlupulone

Chemical Formula:

C₂₁H₂₉O₄

Molecular Weight:

345.458 Daltons

Monoisotopic Mass:

346.2144094514 Daltons

SMILES:

CCC(C)C(C1(C(=C(C(=C(C=1O)CC=C(C)C)[O-])CC=C(C)C)O))=O

InChI:

1S/C21H30O4/c1-7-14(6)18(22)17-20(24)15(10-8-12(2)3)19(23)16(21(17)25)11-9-13(4)5/h8-9,14,23-25H,7,10-11H2,1-6H3/p-1

InChIKey:

VXESUOYBWMDWCJ-UHFFFAOYSA-M

Synonyms

Databases

MetaCyc: CPD-19789

PubChem (CID): 126961032