input word = C00013698

Metabolite InformationStructural formula
Name 6-Hydroxyluteolin 5,6,3',4'-tetramethyl eter 7-cellobioside
2-(3,4-Dimethoxyphenyl)-7-[(4-O-beta-D-glucopyranosyl-beta-D-glucopyranosyl)oxy]-5,6-dimethoxy-4H-1-benzopyran-4-one
Formula C31H38O17
Mw 682.21089979
CAS RN 222025-50-5
C_ID C00013698 ,
InChIKey NFQSGUMEUIEJAI-JWEZEGEHNA-N
InChICode InChI=1S/C31H38O17/c1-40-14-6-5-12(7-16(14)41-2)15-8-13(34)21-17(44-15)9-18(28(42-3)29(21)43-4)45-30-26(39)24(37)27(20(11-33)47-30)48-31-25(38)23(36)22(35)19(10-32)46-31/h5-9,19-20,22-27,30-33,35-39H,10-11H2,1-4H3/t19-,20-,22-,23+,24+,25-,26-,27-,30-,31+/m1/s1
SMILES c1c(cc(c(c1)OC)OC)c1oc2c(c(=O)c1)c(c(c(c2)O[C@H]1[C@@H]([C@@H]([C@@H]([C@H](O1)CO)O[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O)O)O)OC)OC
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeSphaeranthus indicus Ref.
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