input word = C00056631

Metabolite InformationStructural formula
Name 6''-O-Malonylvitexin
Formula C24H22O13
Mw 518.10604079
CAS RN 1206785-66-1
C_ID C00056631
InChIKey UPZWLCRQDFPDHJ-OIQDKXCASA-N
InChICode InChI=1S/C24H22O13/c25-10-3-1-9(2-4-10)14-6-13(28)18-11(26)5-12(27)19(23(18)36-14)24-22(34)21(33)20(32)15(37-24)8-35-17(31)7-16(29)30/h1-6,15,20-22,24-27,32-34H,7-8H2,(H,29,30)/t15-,20-,21+,22-,24+/m1/s1
SMILES O=C(O)CC(=O)OC[C@H]1O[C@@H](c2c(O)cc(O)c3c(=O)cc(-c4ccc(O)cc4)oc23)[C@H](O)[C@@H](O)[C@@H]1O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaePoaceaeEleusine coracana Ref.
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