input word = C00039585

Metabolite InformationStructural formula
Name Kopsimaline D
(+)-Kopsimaline D
Formula C24H26N2O10
Mw 502.15874507
CAS RN 1005004-49-8
C_ID C00039585 ,
InChIKey XMKHYZHGKGQZTD-NLHBFBGPNA-N
InChICode InChI=1S/C24H26N2O10/c1-32-19(29)24(31)18(28)23-13(27)7-22(24)21(5-6-25(17(21)23)8-12-16(23)36-12)10-3-4-11-15(35-9-34-11)14(10)26(22)20(30)33-2/h3-4,12-13,16-18,27-28,31H,5-9H2,1-2H3/t12-,13-,16-,17+,18+,21+,22-,23+,24+/m0/s1
SMILES [C@]123[C@]4(C[C@@H]([C@@]5([C@@H]1N(C[C@H]1[C@@H]5O1)CC3)[C@H]([C@]4(C(=O)OC)O)O)O)N(c1c2ccc2c1OCO2)C(=O)OC
Start Substs in Alk. Biosynthesis (Prediction) L-Tyr Secologanin
Organism
Kingdom Family Species Reference
PlantaeApocynaceaeKopsia singapurensis Ref.
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OrganismKopsia singapurensis
ReferenceSubramaniam,J.Nat.Prod.,71,(2008),53