input word = C00035977

Metabolite InformationStructural formula
Name 7-O-alpha-D-glucopyranosyl-3,5-dihydroxy-3'-(4''-acetoxyl-3''-methylbutyl)-6,4'-dimethoxyflavone
Formula C30H36O14
Mw 620.21050586
CAS RN 773074-09-2
C_ID C00035977 ,
InChIKey RKALOQXJCHTVHF-CIRSSLEGNA-N
InChICode InChI=1S/C30H36O14/c1-13(12-41-14(2)32)5-6-15-9-16(7-8-17(15)39-3)28-26(37)23(34)21-18(42-28)10-19(29(40-4)24(21)35)43-30-27(38)25(36)22(33)20(11-31)44-30/h7-10,13,20,22,25,27,30-31,33,35-38H,5-6,11-12H2,1-4H3/t13-,20-,22-,25+,27-,30+/m1/s1
SMILES c1(c(c(c2c(c1)oc(c(c2=O)O)c1ccc(c(c1)CC[C@H](COC(=O)C)C)OC)O)OC)O[C@@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeVerbenaceaeDuranta repens Ref.
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