input word = C00006308

Metabolite InformationStructural formula
Name Isovitexin 7-O-xyloside-2''-O-glucoside
Formula C32H38O19
Mw 726.20072904
CAS RN 84842-16-0
C_ID C00006308 ,
InChIKey BICGASJNMVSQHP-MYFZRVOYNA-N
InChICode InChI=1S/C32H38O19/c33-7-17-23(40)26(43)30(51-32-28(45)25(42)22(39)18(8-34)50-32)29(48-17)20-16(49-31-27(44)21(38)13(37)9-46-31)6-15-19(24(20)41)12(36)5-14(47-15)10-1-3-11(35)4-2-10/h1-6,13,17-18,21-23,25-35,37-45H,7-9H2/t13-,17-,18-,21+,22-,23-,25+,26+,27+,28-,29+,30+,31+,32+/m1/s1
SMILES c1(c(c(c2c(c1)oc(cc2=O)c1ccc(cc1)O)O)[C@H]1[C@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O)O[C@H]1[C@H]([C@H]([C@@H](CO1)O)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeCaryophyllaceaeMelandrium album Ref.
PlantaeCaryophyllaceaeSilene dioica Ref.
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