input word = C00039583

Metabolite InformationStructural formula
Name Kopsimaline B
(-)-Kopsimaline B
Formula C23H26N2O8
Mw 458.16891582
CAS RN 1005004-47-6
C_ID C00039583 ,
InChIKey SNYWZYAYAZZSTH-WWIYTMLKNA-N
InChICode InChI=1S/C23H26N2O8/c1-31-18(28)23(30)17(27)20-6-7-22(23)21(8-9-24(16(20)21)10-13-15(20)33-13)11-4-3-5-12(26)14(11)25(22)19(29)32-2/h3-5,13,15-17,26-27,30H,6-10H2,1-2H3/t13-,15-,16-,17+,20+,21+,22-,23+/m0/s1
SMILES COC(=O)N1c2c(O)cccc2[C@@]23CCN4C[C@@H]5O[C@@H]5[C@]5(CC[C@]12[C@](O)(C(=O)OC)[C@@H]5O)[C@H]43
Start Substs in Alk. Biosynthesis (Prediction) Secologanin
Organism
Kingdom Family Species Reference
PlantaeApocynaceaeKopsia singapurensis Ref.
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OrganismKopsia singapurensis
ReferenceSubramaniam,J.Nat.Prod.,71,(2008),53