input word = C00041993

Metabolite InformationStructural formula
Name (+)-Coccuorbiculatine A
Formula C38H42N2O6
Mw 622.30428709
CAS RN 862667-11-6
C_ID C00041993 ,
InChIKey AHRCPZKEUMXXKB-GUZXWJHPNA-O
InChICode InChI=1S/C38H41N2O6/c1-39-15-13-25-20-34(43-5)36-22-28(25)30(39)17-24-9-12-33(42-4)35(19-24)45-26-10-7-23(8-11-26)18-31-29-21-32(41)38(46-36)37(44-6)27(29)14-16-40(31,2)3/h7-12,19-22,31H,13-18H2,1-6H3/q+1/p+1/t31-/m0/s1
SMILES c12c3cc(c(c1)OC)Oc1c(cc4c(c1OC)CC[N+]([C@H]4Cc1ccc(cc1)Oc1c(ccc(CC3=[N+](CC2)C)c1)OC)(C)C)O
Start Substs in Alk. Biosynthesis (Prediction) L-Tyr L-Phe
Organism
Kingdom Family Species Reference
PlantaeMenispermaceaeCocculus orbiculatus Ref.
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OrganismCocculus orbiculatus
ReferenceChang,J.Nat.Prod.,68,(2005),1056