input word = C00006581

Metabolite InformationStructural formula
Name Vestitol-(5'->2)-2'-hydroxyformononetin
Formula C32H26O9
Mw 554.15768243
CAS RN 116743-76-1
C_ID C00006581 ,
InChIKey WSPNILMFFHOXIF-AGDOHHJYNA-N
InChICode InChI=1S/C32H26O9/c1-38-20-6-8-21(25(35)12-20)30-31(37)22-7-5-19(34)11-29(22)41-32(30)24-13-23(26(36)14-28(24)39-2)17-9-16-3-4-18(33)10-27(16)40-15-17/h3-8,10-14,17,33-36H,9,15H2,1-2H3/t17-/m1/s1
SMILES c1(ccc2c(c1)oc(c(c2=O)c1c(cc(cc1)OC)O)c1cc(c(cc1OC)O)[C@H]1COc2c(C1)ccc(c2)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeFabaceaeDalbergia nitidula Ref.
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OrganismDalbergia nitidula
ReferenceHarborne, The Handbook of Natural Flavonoids, 1, (1999), 645,Biflavonyls

Bezuidenhoudt,J.Chem.Soc.Perkin Trans.,1,(1988),1227