input word = C00013757

Metabolite InformationStructural formula
Name Kaempferol 3-apiosyl-(1->4)-rhamnoside-7-rhamnoside
3-[(4-O-D-apio-beta-D-furanosyl-6-deoxy-alpha-L-mannopyranosyl)oxy]-7-[(6-deoxy-alpha-L-mannopyranosyl)oxy]-5-hydroxy-2-(4-hydroxyphenyl)-4H-1-benzopyran-4-one
Formula C32H38O18
Mw 710.20581441
CAS RN 262852-68-6
C_ID C00013757 ,
InChIKey ACJZLOBTPAETBY-MXDIJVHXNA-N
InChICode InChI=1S/C32H38O18/c1-11-19(36)21(38)23(40)29(45-11)47-15-7-16(35)18-17(8-15)48-26(13-3-5-14(34)6-4-13)27(20(18)37)50-30-24(41)22(39)25(12(2)46-30)49-31-28(42)32(43,9-33)10-44-31/h3-8,11-12,19,21-25,28-31,33-36,38-43H,9-10H2,1-2H3/t11-,12-,19-,21+,22+,23-,24-,25-,28+,29-,30-,31-,32-/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[C@H]1[C@H]([C@](O)(CO)CO1)O)O)O)c(cc(c2)O[C@H]1[C@H]([C@@H]([C@H]([C@@H](O1)C)O)O)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeChenopodiaceaeChenopodium murale Ref.
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