input word = C00030179

Metabolite InformationStructural formula
Name Endodesmiadiol
2alpha-Hydroxycanophyllol
Formula C30H50O3
Mw 458.37599546
CAS RN 1033753-69-3
C_ID C00030179 ,
InChIKey HQFULWCDKPRQOS-DPENXJDCNA-N
InChICode InChI=1S/C30H50O3/c1-19-24(33)20(32)16-22-26(19,4)9-8-21-27(22,5)11-12-29(7)23-17-25(2,3)10-14-30(23,18-31)15-13-28(21,29)6/h19-23,31-32H,8-18H2,1-7H3/t19-,20+,21-,22-,23-,26-,27+,28+,29-,30+/m0/s1
SMILES C[C@H]1C(=O)[C@H](O)C[C@@H]2[C@]1(C)CC[C@H]1[C@@]2(C)CC[C@@]2(C)[C@@H]3CC(C)(C)CC[C@]3(CO)CC[C@]12C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeClusiaceae-GuttiferaeEndodesmia calophylloides Ref.
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