input word = C00038808

Metabolite InformationStructural formula
Name Clemochinenoside B
(+)-Clemochinenoside B
Formula C29H34O17
Mw 654.17959966
CAS RN 905298-20-6
C_ID C00038808 ,
InChIKey UOONOYCRERCRDU-IYHMBSKQNA-N
InChICode InChI=1S/C29H34O17/c1-38-14-6-11-4-5-13(14)43-28-23(34)21(32)19(30)17(44-28)10-42-27(37)12-7-15(39-2)25(16(8-12)40-3)46-29-24(35)22(33)20(31)18(45-29)9-41-26(11)36/h4-8,17-24,28-35H,9-10H2,1-3H3/t17-,18+,19-,20-,21-,22-,23+,24+,28+,29-/m0/s1
SMILES COc1cc2ccc1OC1OC(COC(=O)c3cc(OC)c(c(OC)c3)O[C@@H]3O[C@H](COC2=O)[C@@H](O)[C@H](O)[C@H]3O)[C@@H](O)[C@H](O)[C@H]1O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeRubiaceaeAdina polycephala Benth Ref.
zoom in