input word = C00049758

Metabolite InformationStructural formula
Name Triptobenzene M
(+)-Triptobenzene M
Formula C20H28O3
Mw 316.20384476
CAS RN 251340-92-8
C_ID C00049758 ,
InChIKey CJNHGLZCCQFRIU-NQDYJFDNNA-N
InChICode InChI=1S/C20H28O3/c1-12(2)14-9-13-5-6-17-19(3,15(13)10-16(14)22)8-7-18(23)20(17,4)11-21/h9-10,12,17,21-22H,5-8,11H2,1-4H3/t17-,19-,20-/m1/s1
SMILES CC(C)c1cc2c(cc1O)[C@@]1(C)CCC(=O)[C@](C)(CO)[C@@H]1CC2
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeCelastraceaeTripterygium wilfordii Ref.
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