Methyl reserpate

methyl (1R,15S,17R,18R,19S,20S)-17-hydroxy-6,18-dimethoxy-1,3,11,12,14,15,16,17,18,19,20,21-dodecahydroyohimban-19-carboxylate

CAS: 2901-66-8

Molecular Formula	`C23H30N2O5`
Molecular Weight	414.5 g/mol
LogP	1.9
Topological Polar Surface Area	84.0 A2
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	6
Rotatable Bonds	4
Exact Mass	414.21548
Heavy Atoms	30
Complexity	647.0

Chemical Identifiers

CAS Number	2901-66-8
SMILES	`COC1C(CC2CN3CCC4=C(C3CC2C1C(=O)OC)NC5=C4C=CC(=C5)OC)O`
InChIKey	`MDJQWFFIUHUJSB-UQVJXISSSA-N`

📖 Product Overview

Methyl reserpate (CAS: 2901-66-8) is a chemical compound with molecular formula C23H30N2O5 and molecular weight 414.5 g/mol. Its IUPAC systematic name is methyl (1R,15S,17R,18R,19S,20S)-17-hydroxy-6,18-dimethoxy-1,3,11,12,14,15,16,17,18,19,20,21-dodecahydroyohimban-19-carboxylate. LogP 1.9 Topological Polar Surface Area 84.0 A2 Hydrogen Bond Donors 2 Hydrogen Bond Acceptors 6 Rotatable Bonds 4 Exact Mass 414.21548 Heavy Atoms 30 Complexity 647.0 InChI Key: MDJQWFFIUHUJSB-UQVJXISSSA-N. SMILES: COC1C(CC2CN3CCC4=C(C3CC2C1C(=O)OC)NC5=C4C=CC(=C5)OC)O.

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