input word = C00025776

Metabolite InformationStructural formula
Name Bisjatrorrhizine
Bijatrorrhizine
Formula C40H38N2O8
Mw 674.26281621
CAS RN 35470-49-6
C_ID C00025776 ,
InChIKey NHXZRJFEZGSGMU-UHFFFAOYSA-P
InChICode InChI=1S/C40H36N2O8/c1-45-31-9-7-21-15-29-25-17-33(47-3)37(43)35(23(25)11-13-41(29)19-27(21)39(31)49-5)36-24-12-14-42-20-28-22(8-10-32(46-2)40(28)50-6)16-30(42)26(24)18-34(48-4)38(36)44/h7-10,15-20H,11-14H2,1-6H3/p+2
SMILES COc1cc2c(c(-c3c(O)c(OC)cc4c3CC[n+]3cc5c(OC)c(OC)ccc5cc3-4)c1O)CC[n+]1cc3c(OC)c(OC)ccc3cc1-2
Start Substs in Alk. Biosynthesis (Prediction) L-Tyr
Organism
Kingdom Family Species Reference
PlantaeMenispermaceaeJateorhiza palmata Miers Ref.
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OrganismJateorhiza palmata Miers
ReferenceCarvalhas,J.Chem.Soc.,Perkin Trans.,1,(1972),327