input word = C00028289

Metabolite InformationStructural formula
Name Gagaminin
Gagaminine
Formula C36H43NO8
Mw 617.29886736
CAS RN 41060-37-1
C_ID C00028289 ,
InChIKey CQLUYSHACKIUHL-ACRFQOLGNA-N
InChICode InChI=1S/C36H43NO8/c1-23(44-31(40)25-10-7-19-37-22-25)34(41)17-18-36(43)33(34,3)29(45-30(39)12-11-24-8-5-4-6-9-24)21-28-32(2)15-14-27(38)20-26(32)13-16-35(28,36)42/h4-13,19,22-23,27-29,38,41-43H,14-18,20-21H2,1-3H3/b12-11+/t23-,27-,28+,29+,32-,33+,34+,35-,36+/m0/s1
SMILES C1[C@@H](CC2=CC[C@@]3([C@@H]([C@]2(C1)C)C[C@H]([C@]1([C@@]3(CC[C@]1([C@@H](OC(=O)c1cccnc1)C)O)O)C)OC(=O)/C=C/c1ccccc1)O)O
Start Substs in Alk. Biosynthesis (Prediction) L-Asp L-His
Organism
Kingdom Family Species Reference
PlantaeApocynaceaeAraujia sericifera Ref.
PlantaeApocynaceaeCynanchum caudatum Max. Ref.
PlantaeApocynaceaeCynanchum wilfordi Hemsley Ref.
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OrganismCynanchum wilfordi Hemsley
ReferenceLee,Planta Med.,62,(1996),485