input word = C00049058

Metabolite InformationStructural formula
Name (3R)-Vestitol 7-O-glucoside
Formula C22H26O9
Mw 434.15768243
CAS RN 202533-15-1
C_ID C00049058 ,
InChIKey NJODPRHPJQYTHX-NMHJHWLLNA-N
InChICode InChI=1S/C22H26O9/c1-28-13-4-5-15(16(24)7-13)12-6-11-2-3-14(8-17(11)29-10-12)30-22-21(27)20(26)19(25)18(9-23)31-22/h2-5,7-8,12,18-27H,6,9-10H2,1H3/t12-,18+,19+,20-,21+,22+/m0/s1
SMILES c1(O[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)CO)O)O)O)ccc2c(c1)OC[C@H](C2)c1ccc(cc1O)OC
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeFabaceaeGlycyrrhiza uralensis Ref.
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OrganismGlycyrrhiza uralensis
ReferenceHatano,Phytochem.,47,(1998),287