input word = C00033468

Metabolite InformationStructural formula
Name Verpectoside B
(+)-Verpectoside B
Formula C35H46O20
Mw 786.25824391
CAS RN 306287-87-6
C_ID C00033468 ,
InChIKey LKZNLGSMAMRYPE-RCBYOKJBNA-N
InChICode InChI=1S/C35H46O20/c1-14-24(43)26(45)28(47)33(50-14)54-31-30(53-23(42)7-4-15-2-5-17(38)19(40)10-15)22(13-37)52-35(49-9-8-16-3-6-18(39)20(41)11-16)32(31)55-34-29(48)27(46)25(44)21(12-36)51-34/h2-7,10-11,14,21-22,24-41,43-48H,8-9,12-13H2,1H3/b7-4+/t14-,21+,22+,24-,25-,26+,27-,28+,29+,30+,31-,32+,33-,34-,35+/m0/s1
SMILES C[C@@H]1O[C@@H](O[C@@H]2[C@@H](O[C@@H]3O[C@H](CO)[C@H](O)[C@H](O)[C@H]3O)[C@H](OCCc3ccc(O)c(O)c3)O[C@H](CO)[C@H]2OC(=O)/C=C/c2ccc(O)c(O)c2)[C@H](O)[C@H](O)[C@H]1O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaePlantaginaceaeVeronica pectinata var.glandulosa Ref.
PlantaePlantaginaceaeVeronica prectinata var.glandulosa Ref.
zoom in