input word = C00013740

Metabolite InformationStructural formula
Name Kaempferol 7-sophoroside
7-[(2-O-beta-D-Glucopyranosyl-beta-D-glucopyranosyl)oxy]-3,5-dihydroxy-2-(4-hydroxyphenyl)-4H-1-benzopyran-4-one
Formula C27H30O16
Mw 610.15338491
CAS RN 195621-97-7
C_ID C00013740 ,
InChIKey QIIWNLYXERJKDH-WNTVHULTNA-N
InChICode InChI=1S/C27H30O16/c28-7-14-17(32)20(35)23(38)26(41-14)43-25-21(36)18(33)15(8-29)42-27(25)39-11-5-12(31)16-13(6-11)40-24(22(37)19(16)34)9-1-3-10(30)4-2-9/h1-6,14-15,17-18,20-21,23,25-33,35-38H,7-8H2/t14-,15+,17-,18-,20+,21+,23+,25-,26+,27-/m1/s1
SMILES O=c1c(O)c(-c2ccc(O)cc2)oc2cc(O[C@@H]3OC(CO)[C@@H](O)[C@H](O)C3O[C@@H]3OC(CO)[C@@H](O)[C@H](O)C3O)cc(O)c12
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeIridaceaeCrocus sativus Ref.
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