input word = C00006012

Metabolite InformationStructural formula
Name Isorhamnetin 3-(6'''-acetylglucosyl)(1->3)-galactoside
3-[[3-O-(6-O-Acetyl-beta-D-glucopyranosyl)-beta-D-galactopyranosyl]oxy]-5,7-dihydroxy-2-(4-hydroxy-3-methoxyphenyl)-4H-1-benzopyran-4-one
Formula C30H34O18
Mw 682.17451429
CAS RN 139955-72-9
C_ID C00006012 ,
InChIKey ROLNEHAFRSGZQP-SISSRHGPNA-N
InChICode InChI=1S/C30H34O18/c1-10(32)43-9-18-20(36)23(39)24(40)29(46-18)47-27-21(37)17(8-31)45-30(25(27)41)48-28-22(38)19-14(35)6-12(33)7-16(19)44-26(28)11-3-4-13(34)15(5-11)42-2/h3-7,17-18,20-21,23-25,27,29-31,33-37,39-41H,8-9H2,1-2H3/t17-,18+,20+,21-,23-,24+,25+,27+,29-,30-/m0/s1
SMILES c1(cc(c2c(c1)oc(c(c2=O)O[C@H]1[C@@H]([C@@H]([C@H]([C@@H](O1)CO)O)O[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)COC(=O)C)O)O)O)O)c1ccc(c(c1)OC)O)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeBerberidaceaeAchlys triphylla Ref.
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