input word = C00006219

Metabolite InformationStructural formula
Name Isovitexin 2''-O-galactoside
Formula C27H30O15
Mw 594.15847029
CAS RN 101977-24-6
C_ID C00006219 ,
InChIKey RQTTXGQDIROLTQ-SBNIYMNJNA-N
InChICode InChI=1S/C27H30O15/c28-7-15-20(34)23(37)26(42-27-24(38)22(36)19(33)16(8-29)41-27)25(40-15)18-12(32)6-14-17(21(18)35)11(31)5-13(39-14)9-1-3-10(30)4-2-9/h1-6,15-16,19-20,22-30,32-38H,7-8H2/t15-,16+,19-,20+,22-,23-,24+,25-,26-,27-/m0/s1
SMILES O=c1cc(-c2ccc(O)cc2)oc2cc(O)c([C@@H]3OC(CO)[C@@H](O)[C@H](O)C3O[C@@H]3OC(CO)[C@H](O)[C@H](O)C3O)c(O)c12
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaePoaceaeSecale cereale Ref.
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