input word = C00005202

Metabolite InformationStructural formula
Name Kaempferol 3-O-rhamninoside
Kaempferol 3-rhamninoside
Formula C33H40O19
Mw 740.2163791
CAS RN 83170-31-4
C_ID C00005202 ,
InChIKey UYVBMGULWGRDQT-FUHFRVNANA-N
InChICode InChI=1S/C33H40O19/c1-10-19(37)23(41)25(43)32(48-10)51-29-20(38)11(2)47-31(27(29)45)46-9-17-21(39)24(42)26(44)33(50-17)52-30-22(40)18-15(36)7-14(35)8-16(18)49-28(30)12-3-5-13(34)6-4-12/h3-8,10-11,17,19-21,23-27,29,31-39,41-45H,9H2,1-2H3/t10-,11+,17+,19-,20-,21-,23-,24+,25-,26-,27+,29-,31+,32-,33-/m0/s1
SMILES c1(cc(c2c(c1)oc(c(c2=O)O[C@H]1[C@H]([C@@H]([C@H]([C@H](O1)CO[C@H]1[C@@H]([C@H]([C@H]([C@H](O1)C)O)O[C@H]1[C@H]([C@H]([C@H]([C@@H](O1)C)O)O)O)O)O)O)O)c1ccc(cc1)O)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeRhamnaceaeRhamnus disperma Ref.
PlantaeRhamnaceaeRhamnus leptophylla Ref.
PlantaeRhamnaceaeRhamnus petiolaris Ref.
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