input word = C00025978

Metabolite InformationStructural formula
Name O-Acetylalloyohimbine
Alloyohimbine acetate
Formula C23H28N2O4
Mw 396.2049074
CAS RN 81571-22-4
C_ID C00025978 ,
InChIKey AVICMXMDDSGUEL-SAQHLWIANA-N
InChICode InChI=1S/C23H28N2O4/c1-13(26)29-20-8-7-14-12-25-10-9-16-15-5-3-4-6-18(15)24-22(16)19(25)11-17(14)21(20)23(27)28-2/h3-6,14,17,19-21,24H,7-12H2,1-2H3/t14-,17-,19+,20+,21-/m1/s1
SMILES COC(=O)[C@@H]1[C@H]2C[C@H]3c4[nH]c5ccccc5c4CCN3C[C@H]2CC[C@@H]1OC(C)=O
Start Substs in Alk. Biosynthesis (Prediction) L-Trp Secologanin
Organism
Kingdom Family Species Reference
PlantaeApocynaceaeRauwolfia nitida Ref.
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