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

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

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

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

structure
  • CAS No:

    109460-90-4

  • Formula:

    C28H29N3O7

  • Chemical Name:

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

  • Synonyms:

    14 beta-(4-nitrobenzoyloxy)yohimbine;14-(4-nitrobenzoyloxy)yohimbine;14-NBO-yohimbine;14-Nbo-yohimbine;109460-90-4;14-(4-Nitrobenzoyloxy)yohimbine;14beta-(4-Nitrobenzoyloxy)yohimbine;DTXSID30911175;Methyl 17-hydroxy-14-[(4-nitrobenzoyl)oxy]yohimban-16-carboxylate;methyl (1R,15R,18S,19R,20S,21R)-18-hydroxy-21-(4-nitrobenzoyl)oxy-1,3,11,12,14,15,16,17,18,19,20,21-dodecahydroyohimban-19-carboxylate;Yohimban-16-carboxylic acid, 17-hydroxy-14-((4-nitrobenzoyl)oxy)-, methyl ester, (14beta,16alpha,17alpha)-

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

519.5 g/mol

519.20055027 g/mol

Characteristics

138 Ų

Drug Information

14 beta-(4-nitrobenzoyloxy)yohimbine

Computed Properties

Molecular Weight:519.5
XLogP3:4
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:5
Exact Mass:519.20055027
Monoisotopic Mass:519.20055027
Topological Polar Surface Area:138
Heavy Atom Count:38
Complexity:919
Defined Atom Stereocenter Count:6
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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

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