input word = C00051628

Metabolite InformationStructural formula
Name Monnieraside II
Formula C24H28O11
Mw 492.16316174
CAS RN 478036-63-4
C_ID C00051628
InChIKey CELUHKZRIDESEX-NVSZSDCUNA-N
InChICode InChI=1S/C24H28O11/c1-32-18-11-13(3-6-16(18)27)4-7-20(29)35-23-22(31)21(30)19(12-25)34-24(23)33-9-8-14-2-5-15(26)17(28)10-14/h2-7,10-11,19,21-28,30-31H,8-9,12H2,1H3/b7-4+/t19-,21-,22+,23-,24-/m1/s1
SMILES COc1cc(/C=C/C(=O)O[C@H]2[C@H](OCCc3ccc(O)c(O)c3)O[C@H](CO)[C@@H](O)[C@@H]2O)ccc1O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaePlantaginaceaeBacopa monniera Ref.
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OrganismBacopa monniera
ReferenceLOPEZ-MARTIN, et al., Chem Pharm Bull, 50, (2002), 1616