input word = C00006367

Metabolite InformationStructural formula
Name 3'-Methoxypuerarin
Pueraria glycoside 3
Formula C22H22O10
Mw 446.12129692
CAS RN 117047-07-1
C_ID C00006367 ,
InChIKey HQQUZVFMUSCUJS-PLAKOYNZNA-N
InChICode InChI=1S/C22H22O10/c1-30-14-6-9(2-4-12(14)24)11-8-31-21-10(17(11)26)3-5-13(25)16(21)22-20(29)19(28)18(27)15(7-23)32-22/h2-6,8,15,18-20,22-25,27-29H,7H2,1H3/t15-,18+,19-,20+,22-/m0/s1
SMILES c1(ccc2c(c1[C@H]1[C@@H]([C@H]([C@@H]([C@@H](O1)CO)O)O)O)occ(c2=O)c1ccc(c(c1)OC)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeFabaceaePueraria lobata Ref.
PlantaeFabaceaePueraria montana var. lobata Ref.
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OrganismPueraria montana var. lobata
ReferenceKinjo,Chem. Pharm. Bull.,35,(1987),4846