input word = C00005348

Metabolite InformationStructural formula
Name Herbacetin 7-rhamnoside-8-glucoside
Formula C27H30O16
Mw 610.15338491
CAS RN 94696-40-9
C_ID C00005348 ,
InChIKey CQFZDNWCTZWQSH-FWOHOWCGNA-N
InChICode InChI=1S/C27H30O16/c1-8-15(31)18(34)21(37)26(39-8)40-12-6-11(30)14-17(33)20(36)23(9-2-4-10(29)5-3-9)42-25(14)24(12)43-27-22(38)19(35)16(32)13(7-28)41-27/h2-6,8,13,15-16,18-19,21-22,26-32,34-38H,7H2,1H3/t8-,13+,15-,16+,18-,19-,21+,22+,26-,27-/m0/s1
SMILES c1(cc(c2c(c1O[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O)oc(c(c2=O)O)c1ccc(cc1)O)O)O[C@@H]1O[C@H]([C@@H]([C@@H]([C@H]1O)O)O)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeCrassulaceaeRhodiola rosea Ref.
zoom in