input word = C00006024

Metabolite InformationStructural formula
Name Patuletin 3-rhamnoside-7-(3'''-acetylrhamnoside)
Formula C30H34O17
Mw 666.17959966
CAS RN 125140-14-9
C_ID C00006024 ,
InChIKey GZZWBJBTMBMOPQ-JYYGHOKFNA-N
InChICode InChI=1S/C30H34O17/c1-9-18(34)22(38)23(39)29(42-9)47-28-21(37)17-15(45-25(28)12-5-6-13(32)14(33)7-12)8-16(26(41-4)20(17)36)46-30-24(40)27(44-11(3)31)19(35)10(2)43-30/h5-10,18-19,22-24,27,29-30,32-36,38-40H,1-4H3/t9-,10+,18+,19+,22+,23+,24+,27+,29+,30-/m1/s1
SMILES COc1c(O[C@H]2OC(C)[C@H](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 brasiliensis Ref.
PlantaeCrassulaceaeKalanchoe gracilis Ref.
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