Home/Compounds/Pharmaceutical Intermediate/(2b,3a,5a,16b,17b)-2-(4-Morpholinyl)-16-(1-pyrrolidinyl)androstane-3,17-diol
C54H92N4O6
893.3 g/mol
Pharmaceutical IntermediateWarning
(2b,3a,5a,16b,17b)-2-(Morpholin-4-yl)-16-(pyrrolidin-1-yl)androstane-3,17-diol
CAS119302-20-4
Category
Pharmaceutical Intermediate
Compound Class
Steroid
Primary Use
Pharmaceutical Intermediate
This compound is a steroidal pharmaceutical intermediate used in the manufacture of neuromuscular blocking agents. It is characterized as a salt-like, multi-fragment structure with multiple stereocenters, containing alcohol, amine, and ether functional groups.
Pharmaceutical intermediate for neuromuscular blockers
Content scope: Information here supports chemical identification and industrial supply, research, and manufacturing contexts. It is not a therapeutic claim, medical advice, or drug-use instructions.
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CAS 119302-20-4
Related Compounds
SimilarStructure SimilarSimilarity 0.73
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Safety Reference
Warning
H302Harmful if swallowed
H312Harmful in contact with skin
H332Harmful if inhaled
Identifiers
IUPAC Name
(2S,3S,5S,8R,9R,10S,13S,14R,16S,17R)-10,13-dimethyl-2-morpholin-4-yl-16-pyrrolidin-1-yl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthrene-3,17-diol;(2S,3S,5S,8R,9S,10S,13S,14S,16S,17R)-10,13-dimethyl-2-morpholin-4-yl-16-pyrrolidin-1-yl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthrene-3,17-diol
InChIKey
AQOKTKOEOSDJRC-NJYHMWOTSA-N
SMILES
C[C@]12CC[C@@H]3[C@H]([C@H]1C[C@@H]([C@@H]2O)N4CCCC4)CC[C@@H]5[C@@]3(C[C@@H]([C@H](C5)O)N6CCOCC6)C.C[C@]12CC[C@H]3[C@H]([C@@H]1C[C@@H]([C@@H]2O)N4CCCC4)CC[C@@H]5[C@@]3(C[C@@H]([C@H](C5)O)N6CCOCC6)C
Synonyms (4)
- Desallyl deacetyl rocuronium