 Home > Encyclopedia > methyl (1R,15S,17R,18R,19S,20S)-17-(4-aminobenzoyl)oxy-6,18-dimethoxy-1,3,11,12,14,15,16,17,18,19,20,21-dodecahydroyohimban-19-carboxylate

methyl (1R,15S,17R,18R,19S,20S)-17-(4-aminobenzoyl)oxy-6,18-dimethoxy-1,3,11,12,14,15,16,17,18,19,20,21-dodecahydroyohimban-19-carboxylate

methyl (1R,15S,17R,18R,19S,20S)-17-(4-aminobenzoyl)oxy-6,18-dimethoxy-1,3,11,12,14,15,16,17,18,19,20,21-dodecahydroyohimban-19-carboxylate structure

CAS No:
6937-99-1
Formula:
C30H35N3O6
Chemical Name:
methyl (1R,15S,17R,18R,19S,20S)-17-(4-aminobenzoyl)oxy-6,18-dimethoxy-1,3,11,12,14,15,16,17,18,19,20,21-dodecahydroyohimban-19-carboxylate
Synonyms:
MLS000737605;SMR000393776;NSC29858;Opera_ID_1496;cid_232432;CHEMBL1326032;BDBM63814;HMS2773D24;NSC-29858;(1R,15S,17R,18R,19S,20S)-17-(4-aminobenzoyl)oxy-6,18-dimethoxy-1,3,11,12,14,15,16,17,18,19,20,21-dodecahydroyohimban-19-carboxylic acid methyl ester;(1R,15S,17R,18R,19S,20S)-17-[(4-aminophenyl)-oxomethoxy]-6,18-dimethoxy-1,3,11,12,14,15,16,17,18,19,20,21-dodecahydroyohimban-19-carboxylic acid methyl ester;6937-99-1;methyl (1R,15S,17R,18R,19S,20S)-17-(4-aminobenzoyl)oxy-6,18-dimethoxy-1,3,11,12,14,15,16,17,18,19,20,21-dodecahydroyohimban-19-carboxylate;methyl (1R,15S,17R,18R,19S,20S)-17-(4-aminophenyl)carbonyloxy-6,18-dimethoxy-1,3,11,12,14,15,16,17,18,19,20,21-dodecahydroyohimban-19-carboxylate

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methyl (1R,15S,17R,18R,19S,20S)-17-(4-aminobenzoyl)oxy-6,18-dimethoxy-1,3,11,12,14,15,16,17,18,19,20,21-dodecahydroyohimban-19-carboxylate Basic Attributes

Molecular Weight：

533.6 g/mol

Exact Mass：

533.25258584 g/mol

NSC Number：

29858

Characteristics

PSA：

116 Å²

Computed Properties

Molecular Weight:533.6
XLogP3:3.5
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:7
Exact Mass:533.25258584
Monoisotopic Mass:533.25258584
Topological Polar Surface Area:116
Heavy Atom Count:39
Complexity:896
Defined Atom Stereocenter Count:6
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of methyl (1R,15S,17R,18R,19S,20S)-17-(4-aminobenzoyl)oxy-6,18-dimethoxy-1,3,11,12,14,15,16,17,18,19,20,21-dodecahydroyohimban-19-carboxylate

Basic Attributes
Characteristics
Computed Properties
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