input word = C00006029

Metabolite InformationStructural formula
Name Patuletin 3-rhamnoside-7-(3''',4'''-diacetylrhamnoside)
Formula C32H36O18
Mw 708.19016435
CAS RN 125140-16-1
C_ID C00006029 ,
InChIKey AZUUVSJJSGCVGM-FQZLUHJQNA-N
InChICode InChI=1S/C32H36O18/c1-10-20(37)23(40)24(41)31(44-10)50-29-22(39)19-17(48-27(29)14-6-7-15(35)16(36)8-14)9-18(28(43-5)21(19)38)49-32-25(42)30(47-13(4)34)26(11(2)45-32)46-12(3)33/h6-11,20,23-26,30-32,35-38,40-42H,1-5H3/t10-,11+,20+,23-,24+,25+,26+,30+,31+,32-/m1/s1
SMILES COc1c(O[C@H]2OC(C)[C@H](OC(C)=O)[C@H](OC(C)=O)C2O)cc2oc(-c3ccc(O)c(O)c3)c(O[C@@H]3OC(C)[C@H](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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