input word = C00025092

Metabolite InformationStructural formula
Name Humantenine
Gelsenidine
Formula C21H26N2O3
Mw 354.19434271
CAS RN 82375-29-9
C_ID C00025092 ,
InChIKey SJKRPUOXUNOPOP-WHPATKCENA-N
InChICode InChI=1S/C21H26N2O3/c1-4-13-11-22(2)18-10-21(19-9-14(13)15(18)12-26-19)16-7-5-6-8-17(16)23(25-3)20(21)24/h4-8,14-15,18-19H,9-12H2,1-3H3/b13-4+/t14-,15-,18-,19+,21-/m0/s1
SMILES C/C=C1CN(C)[C@H]2C[C@@]3(C(=O)N(OC)c4ccccc43)[C@H]3C[C@@H]1[C@@H]2CO3
Start Substs in Alk. Biosynthesis (Prediction) L-Trp Secologanin
Organism
Kingdom Family Species Reference
PlantaeGelsemiaceaeGelsemium elegans Ref.
PlantaeGelsemiaceaeGelsemium rankinii Ref.
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OrganismGelsemium rankinii
ReferenceDu,Acta Chim.Sinica,40,(1982),1137

Yang,Acta Chim.Sinica,18,(1983),104

Yang,Acta Chim.Sinica,19,(1984),686

Yeh,J.Nat.Prod.,49,(1986),806