input word = C00013760

Metabolite InformationStructural formula
Name Kaempferol 3-glucosyl-(1->2)-rhamnoside-7-glucoside
3-[(6-Deoxy-2-O-beta-D-glucopyranosyl-alpha-L-mannopyranosyl)oxy]-7-(beta-D-glucopyranosyloxy)-5-hydroxy-2-(4-hydroxyphenyl)-4H-1-benzopyran-4-one
Formula C33H40O20
Mw 756.21129372
CAS RN 245036-41-3
C_ID C00013760 ,
InChIKey HJJIIDXKQCWRHQ-FAXRCTNUNA-N
InChICode InChI=1S/C33H40O20/c1-10-19(38)25(44)30(53-32-27(46)24(43)21(40)17(9-35)51-32)33(47-10)52-29-22(41)18-14(37)6-13(48-31-26(45)23(42)20(39)16(8-34)50-31)7-15(18)49-28(29)11-2-4-12(36)5-3-11/h2-7,10,16-17,19-21,23-27,30-40,42-46H,8-9H2,1H3/t10-,16-,17+,19-,20+,21+,23-,24-,25+,26+,27-,30-,31+,32-,33-/m0/s1
SMILES c1c(ccc(c1)O)c1oc2c(c(=O)c1O[C@H]1[C@H]([C@@H]([C@H]([C@@H](O1)C)O)O)O[C@H]1[C@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O)c(cc(c2)O[C@H]1[C@@H]([C@H]([C@@H]([C@@H](O1)CO)O)O)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeGinkgoaceaeGinkgo biloba Ref.
PlantaeIridaceaeCrocus chrysanthus Ref.
zoom in