input word = C00005362

Metabolite InformationStructural formula
Name Sexangularetin 3-rhamnoside-7-glucoside
Formula C28H32O16
Mw 624.16903498
CAS RN 85966-35-4
C_ID C00005362 ,
InChIKey OISDRTXCDFHKEA-QJQDYSTENA-N
InChICode InChI=1S/C28H32O16/c1-9-16(32)19(35)21(37)27(40-9)44-26-18(34)15-12(31)7-13(41-28-22(38)20(36)17(33)14(8-29)42-28)24(39-2)25(15)43-23(26)10-3-5-11(30)6-4-10/h3-7,9,14,16-17,19-22,27-33,35-38H,8H2,1-2H3/t9-,14-,16-,17-,19+,20-,21-,22+,27-,28+/m0/s1
SMILES COc1c(O[C@@H]2OC(CO)[C@@H](O)[C@H](O)C2O)cc(O)c2c(=O)c(O[C@@H]3OC(C)[C@H](O)C(O)[C@@H]3O)c(-c3ccc(O)cc3)oc12
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeFabaceaeLotus corniculatus Ref.
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