methyl (1R,15S,17R,18R,19S,20S)-18-methoxy-17-(3,4,5-trimethoxybenzoyl)oxy-1,3,11,12,14,15,16,17,18,19,20,21-dodecahydroyohimban-19-carboxylate

CAS: 131-01-1

Molecular Formula	`C32H38N2O8`
Molecular Weight	578.7 g/mol
LogP	4.1
Topological Polar Surface Area	109.0 A2
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	9
Rotatable Bonds	9
Exact Mass	578.2628
Heavy Atoms	42
Complexity	953.0

Chemical Identifiers

CAS Number	131-01-1
SMILES	`COC1C(CC2CN3CCC4=C(C3CC2C1C(=O)OC)NC5=CC=CC=C45)OC(=O)C6=CC(=C(C(=C6)OC)OC)OC`
InChIKey	`CVBMAZKKCSYWQR-WCGOZPBSSA-N`

📖 Product Overview

methyl (1R,15S,17R,18R,19S,20S)-18-methoxy-17-(3,4,5-trimethoxybenzoyl)oxy-1,3,11,12,14,15,16,17,18,19,20,21-dodecahydroyohimban-19-carboxylate (CAS: 131-01-1) is a chemical compound with molecular formula C32H38N2O8 and molecular weight 578.7 g/mol. Its IUPAC systematic name is methyl (1R,15S,17R,18R,19S,20S)-18-methoxy-17-(3,4,5-trimethoxybenzoyl)oxy-1,3,11,12,14,15,16,17,18,19,20,21-dodecahydroyohimban-19-carboxylate. LogP 4.1 Topological Polar Surface Area 109.0 A2 Hydrogen Bond Donors 1 Hydrogen Bond Acceptors 9 Rotatable Bonds 9 Exact Mass 578.2628 Heavy Atoms 42 Complexity 953.0 InChI Key: CVBMAZKKCSYWQR-WCGOZPBSSA-N. SMILES: COC1C(CC2CN3CCC4=C(C3CC2C1C(=O)OC)NC5=CC=CC=C45)OC(=O)C6=CC(=C(C(=C6)OC)OC)OC.

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Multi-source research profile: chemical properties, regulatory status, and sourcing guide for methyl (1R,15S,17R,18R,19S,20S)-18-methoxy-17-(3,4,5-trimethoxybenzoyl)oxy-1,3,11,12,14,15,16,17,18,19,20,21-dodecahydroyohimban-19-carboxylate.

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