input word = C00006001

Metabolite InformationStructural formula
Name Rhamnetin 3-rhamnosyl-(1->3)(4'''-acetylrhamnosyl)(1->6)-galactoside
Formula C36H44O21
Mw 812.23750847
CAS RN 83170-27-8
C_ID C00006001 ,
InChIKey SNWSDJIWOIJZFI-NMGKVTCNNA-N
InChICode InChI=1S/C36H44O21/c1-11-22(41)25(44)27(46)35(51-11)57-33-29(48)34(52-12(2)30(33)53-13(3)37)50-10-20-23(42)26(45)28(47)36(55-20)56-32-24(43)21-18(40)8-15(49-4)9-19(21)54-31(32)14-5-6-16(38)17(39)7-14/h5-9,11-12,20,22-23,25-30,33-36,38-42,44-48H,10H2,1-4H3/t11-,12+,20-,22+,23+,25+,26+,27-,28-,29-,30+,33-,34-,35+,36+/m1/s1
SMILES COc1cc(O)c2c(=O)c(O[C@@H]3OC(CO[C@@H]4OC(C)[C@H](OC(C)=O)[C@H](O[C@@H]5OC(C)[C@H](O)[C@H](O)C5O)C4O)[C@H](O)C(O)C3O)c(-c3ccc(O)c(O)c3)oc2c1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeRhamnaceaeRhamnus saxatilis Ref.
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