input word = C00006030

Metabolite InformationStructural formula
Name Patuletin 3-(4''-acetylrhamnoside)-7-(2''',4'''-diacetylrhamnoside)
Formula C34H38O19
Mw 750.20072904
CAS RN 125140-19-4
C_ID C00006030 ,
InChIKey MGKIOPQAOQPPKQ-ZFGKWLAGNA-N
InChICode InChI=1S/C34H38O19/c1-11-27(48-13(3)35)24(42)25(43)33(46-11)53-31-23(41)21-19(51-29(31)16-7-8-17(38)18(39)9-16)10-20(30(45-6)22(21)40)52-34-32(50-15(5)37)26(44)28(12(2)47-34)49-14(4)36/h7-12,24-28,32-34,38-40,42-44H,1-6H3/t11-,12-,24+,25-,26-,27-,28-,32+,33-,34+/m0/s1
SMILES COc1c(O[C@H]2OC(C)[C@H](OC(C)=O)[C@H](O)C2OC(C)=O)cc2oc(-c3ccc(O)c(O)c3)c(O[C@@H]3OC(C)[C@H](OC(C)=O)C(O)[C@@H]3O)c(=O)c2c1O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeCrassulaceaeKalanchoe gracilis Ref.
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