input word = C00025857

Metabolite InformationStructural formula
Name Dimethylwarifteine
O,O-Dimethylwarifteine
O-Methylcissampareine
Formula C38H40N2O6
Mw 620.28863702
CAS RN 7678-91-3
C_ID C00025857 ,
InChIKey SYFXEESYCUKCFP-ITTNFTAPNA-N
InChICode InChI=1S/C38H40N2O6/c1-40-17-15-27-21-31(41-2)35(43-4)38-34(27)30(40)19-24-6-8-25(9-7-24)22-45-36-32(42-3)20-26-14-16-39-29(33(26)37(36)44-5)18-23-10-12-28(46-38)13-11-23/h6-13,20-21,30H,14-19,22H2,1-5H3/t30-/m1/s1
SMILES c12c3[C@H](N(CCc3cc(c1OC)OC)C)Cc1ccc(cc1)COc1c(c3c(CCN=C3Cc3ccc(O2)cc3)cc1OC)OC
Start Substs in Alk. Biosynthesis (Prediction) L-Tyr
Organism
Kingdom Family Species Reference
PlantaeMenispermaceaeCissampelos ovalifolia DC. Ref.
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OrganismCissampelos ovalifolia DC.
ReferenceSnedden,Org.Mass Spec.,4,(1970),607