input word = C00026852

Metabolite InformationStructural formula
Name 3,4,5,6-Tetradehydroyohimbine
Formula C21H23N2O3
Mw 351.17086762
CAS RN 50834-28-1
C_ID C00026852 ,
InChIKey UWMTZXSCMQAECK-AAGLXVOBNA-O
InChICode InChI=1S/C21H22N2O3/c1-26-21(25)19-15-10-17-20-14(13-4-2-3-5-16(13)22-20)8-9-23(17)11-12(15)6-7-18(19)24/h2-5,8-9,12,15,18-19,24H,6-7,10-11H2,1H3/p+1/t12-,15+,18-,19+/m0/s1
SMILES c1ccc2c(c1)c1c([nH]2)c2[n+](cc1)C[C@H]1[C@@H](C2)[C@H]([C@H](CC1)O)C(=O)OC
Start Substs in Alk. Biosynthesis (Prediction) L-Trp Secologanin
Organism
Kingdom Family Species Reference
PlantaeApocynaceaeCatharanthus roseus Ref.
PlantaeApocynaceaeRauvolfia serpentina Ref.
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