input word = C00054647

Metabolite InformationStructural formula
Name Camellenodiol
Formula C29H46O3
Mw 442.34469533
CAS RN 81426-91-7
C_ID C00054647
InChIKey DNIUVLCJWDCWGK-VHNCRUBHSA-N
InChICode InChI=1S/C29H46O3/c1-24(2)14-15-29(32)19(16-24)18-8-9-21-26(5)12-11-22(30)25(3,4)20(26)10-13-27(21,6)28(18,7)17-23(29)31/h8,19-22,30,32H,9-17H2,1-7H3/t19-,20-,21+,22-,26-,27+,28+,29+/m0/s1
SMILES O[C@H]1CC[C@@]2(C)[C@](CC[C@]3(C)[C@]2([H])CC=C4[C@@]3(C)CC([C@]5(O)[C@@]4([H])CC(C)(C)CC5)=O)([H])C1(C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeTheaceaeCamellia japonica Ref.
zoom in



OrganismCamellia japonica
ReferenceItokawa, H. et al., Phytochemistry, 1981, 20, 2539-2542 (isol)