Structure

(-)-Isoreserpine

CAS
482-85-9
Catalog Number
ACM482859
Category
Main Products
Molecular Weight
608.68
Molecular Formula
C33H40N2O9

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Specification

Synonyms
(-)-ISORESERPINE;(20α)-18β-(3,4,5-Trimethoxybenzoyloxy)-11,17α-dimethoxyyohimban-16β-carboxylic acid methyl ester;20alpha-Yohimban-16beta-carboxylic acid, 18beta-hydroxy-11,17alpha-dimethoxy-, methyl ester, 3,4,5-trimethoxybenzoate (ester) (8ci);3-Epireserpine;Isoreserpin;Nsc 80138;Yohimban-16-carboxylic acid, 11,17-dimethoxy-18-((3,4,5-trimethoxybenzoyl)oxy)-, methyl ester, (16beta,17alpha,18beta,20alpha)- (9ci)
IUPAC Name
methyl(1S,15S,17R,18R,19S,20S)-6,18-dimethoxy-17-(3,4,5-trimethoxybenzoyl)oxy-1,3,11,12,14,15,16,17,18,19,20,21-dodecahydroyohimban-19-carboxylate
Canonical SMILES
COC1C(CC2CN3CCC4=C(C3CC2C1C(=O)OC)NC5=C4C=CC(=C5)OC)OC(=O)C6=CC(=C(C(=C6)OC)OC)OC
InChI Key
QEVHRUUCFGRFIF-VPHNHGCZSA-N
Boiling Point
700.1ºC at 760mmHg
Melting Point
148-155°C(lit.)
Flash Point
377.2ºC
Density
1.32g/cm³
Exact Mass
608.27300
Packing Group
III
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