input word = C00043125

Metabolite InformationStructural formula
Name Zumsenin
(+)-Zumsenin
Formula C30H36O8
Mw 524.24101813
CAS RN 638181-26-7
C_ID C00043125 ,
InChIKey KSEPBLBDIIHMMF-HENPKCHFNA-N
InChICode InChI=1S/C30H36O8/c1-15(31)36-24-25-29(6,22(34)12-21-27(3,4)38-23-11-18(33)13-30(21,23)25)20-8-7-19(17-9-10-35-14-17)28(20,5)26(24)37-16(2)32/h8-10,14,19,21,23-26H,7,11-13H2,1-6H3/t19-,21-,23-,24+,25-,26-,28-,29+,30+/m0/s1
SMILES CC(=O)O[C@H]1[C@H](OC(C)=O)[C@]2(C)C(=CC[C@H]2c2ccoc2)[C@]2(C)C(=O)C[C@H]3C(C)(C)O[C@H]4CC(=O)C[C@]43[C@@H]12
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeEuphorbiaceaeCroton jatrophoides Ref.
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