input word = C00006216

Metabolite InformationStructural formula
Name Vitexin 4'-O-glucoside
Formula C27H30O15
Mw 594.15847029
CAS RN 38950-94-6
C_ID C00006216 ,
InChIKey CQJPSSJEHVNDFL-HQORTFQONA-N
InChICode InChI=1S/C27H30O15/c28-7-15-19(33)21(35)23(37)26(41-15)18-12(31)5-11(30)17-13(32)6-14(40-25(17)18)9-1-3-10(4-2-9)39-27-24(38)22(36)20(34)16(8-29)42-27/h1-6,15-16,19-24,26-31,33-38H,7-8H2/t15-,16-,19-,20-,21+,22-,23-,24-,26+,27-/m1/s1
SMILES O=c1cc(-c2ccc(O[C@@H]3OC(CO)[C@@H](O)C(O)C3O)cc2)oc2c([C@@H]3OC(CO)[C@@H](O)[C@H](O)C3O)c(O)cc(O)c12
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaePassifloraceaePassiflora coactilis Ref.
PlantaePoaceaeBriza media Ref.
zoom in