(13E)-labda-7,13-dien-15-yl diphosphate

Chemical Formula:

C₂₀H₃₃O₇P₂

Molecular Weight:

447.424 Daltons

Monoisotopic Mass:

450.1936265303 Daltons

SMILES:

CC(=CCOP([O-])(=O)OP([O-])([O-])=O)CCC2(C(C)=CC[CH]1(C(C)(CCCC(C)(C)1)2))

InChI:

1S/C20H36O7P2/c1-15(11-14-26-29(24,25)27-28(21,22)23)7-9-17-16(2)8-10-18-19(3,4)12-6-13-20(17,18)5/h8,11,17-18H,6-7,9-10,12-14H2,1-5H3,(H,24,25)(H2,21,22,23)/p-3/b15-11+/t17-,18-,20+/m0/s1

InChIKey:

CYXMSAANDYUEKO-ATPOGHATSA-K

Synonyms

(13E)-labda-7,13-dienyl diphosphate

Databases

MetaCyc: CPD-15177

PubChem (CID): 90658534 129900390

ChEBI: 63682

MetaNetX: MNXM4155