input word = C00037680

Metabolite InformationStructural formula
Name Premnaionoside
Formula C24H40O12
Mw 520.25197674
CAS RN 272458-28-3
C_ID C00037680 ,
InChIKey YABRKIPLNHWVOR-SLIMPXPFNA-N
InChICode InChI=1S/C24H40O12/c1-12(5-6-24-21(2,3)7-13(27)8-22(24,4)36-24)33-19-17(16(29)15(28)14(9-25)34-19)35-20-18(30)23(31,10-26)11-32-20/h5-6,12-20,25-31H,7-11H2,1-4H3/b6-5+/t12-,13+,14-,15+,16+,17-,18+,19-,20+,22-,23-,24+/m1/s1
SMILES C[C@H](/C=C/[C@@]12O[C@]1(C)C[C@@H](O)CC2(C)C)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O[C@@H]1OC[C@](O)(CO)[C@H]1O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAcanthaceaeAcanthus ebracteatus Ref.
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