input word = C00025624

Metabolite InformationStructural formula
Name (-)-Repandine
Repandine
N-Methyldemerarine
Repandin
Formula C37H40N2O6
Mw 608.28863702
CAS RN 518-92-3
C_ID C00025624 ,
InChIKey HGNHIFJNOKGSKI-IMDSDXEONA-N
InChICode InChI=1S/C37H40N2O6/c1-38-14-12-24-19-32(41-3)33-21-27(24)28(38)17-23-8-11-30(40)31(18-23)44-26-9-6-22(7-10-26)16-29-35-25(13-15-39(29)2)20-34(42-4)36(43-5)37(35)45-33/h6-11,18-21,28-29,40H,12-17H2,1-5H3/t28-,29-/m0/s1
SMILES COc1cc2c3cc1Oc1c(OC)c(OC)cc4c1[C@H](Cc1ccc(cc1)Oc1cc(ccc1O)C[C@@H]3N(C)CC2)N(C)CC4
Start Substs in Alk. Biosynthesis (Prediction) L-Tyr L-Phe
Organism
Kingdom Family Species Reference
PlantaeMenispermaceaeCyclea barbata Miers Ref.
PlantaeMenispermaceaeCyclea peltata Diels Ref.
PlantaeMonimiaceaeDaphnandra dielsii Ref.
PlantaeMonimiaceaeDaphnandra repandura Ref.
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OrganismCyclea barbata Miers
ReferenceGuinaudeau,J.Nat.Prod.,56,(1993),1989