input word = C00005352

Metabolite InformationStructural formula
Name Herbacetin 8,4'-dixyloside
Formula C25H26O15
Mw 566.12717016
CAS RN 90193-30-9
C_ID C00005352 ,
InChIKey SGPXUDNIMAZUQQ-BDYDCKQINA-N
InChICode InChI=1S/C25H26O15/c26-10-5-11(27)22(40-25-20(35)16(31)13(29)7-37-25)23-14(10)17(32)18(33)21(39-23)8-1-3-9(4-2-8)38-24-19(34)15(30)12(28)6-36-24/h1-5,12-13,15-16,19-20,24-31,33-35H,6-7H2/t12-,13-,15+,16-,19+,20-,24+,25+/m1/s1
SMILES c1(cc(c2c(c1O[C@H]1[C@@H]([C@@H]([C@@H](CO1)O)O)O)oc(c(c2=O)O)c1ccc(cc1)O[C@H]1[C@H]([C@H]([C@@H](CO1)O)O)O)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeCrassulaceaeRhodiola krylovii Ref.
zoom in