input word = C00020149

Metabolite InformationStructural formula
Name 3'-O-Methylsappanol
Formula C17H18O6
Mw 318.11033831
CAS RN 111254-21-8
C_ID C00020149 ,
InChIKey JIJQATZAZOPDCS-LQKAMQBPNA-N
InChICode InChI=1S/C17H18O6/c1-22-15-6-10(2-5-13(15)19)8-17(21)9-23-14-7-11(18)3-4-12(14)16(17)20/h2-7,16,18-21H,8-9H2,1H3/t16-,17+/m0/s1
SMILES c1(ccc2c(c1)OC[C@@]([C@H]2O)(Cc1cc(c(cc1)O)OC)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeFabaceaeCaesalpinia sappan Ref.
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OrganismCaesalpinia sappan
ReferenceNamikoshi,Chem. Pharm. Bull.,35,(1987),2761