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 CC1(C)CC[C@]2(O)C(=O)C[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@]43C)[C@@H]2C1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeTheaceaeCamellia japonica Ref.
zoom in