input word = C00005281

Metabolite InformationStructural formula
Name Rhamnocitrin 3,4'-diglucoside
Formula C28H32O16
Mw 624.16903498
CAS RN 116183-66-5
C_ID C00005281 ,
InChIKey KKPKUPKKMALLKG-NATGWGOFNA-N
InChICode InChI=1S/C28H32O16/c1-39-12-6-13(31)17-14(7-12)41-25(26(20(17)34)44-28-24(38)22(36)19(33)16(9-30)43-28)10-2-4-11(5-3-10)40-27-23(37)21(35)18(32)15(8-29)42-27/h2-7,15-16,18-19,21-24,27-33,35-38H,8-9H2,1H3/t15-,16-,18-,19-,21+,22+,23-,24-,27-,28+/m1/s1
SMILES COc1cc(O)c2c(=O)c(O[C@@H]3OC(CO)[C@@H](O)C(O)C3O)c(-c3ccc(O[C@@H]4OC(CO)[C@@H](O)C(O)C4O)cc3)oc2c1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeFabaceaeAstragalus complanatus Ref.
PlantaeMyrsinaceaeLysimachia christinae Ref.
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