(2S,3S,5S,8R,9S,10S,13S,14S,16S,17R)-10,13-dimethyl-2,16-bis(1-methylpiperidin-1-ium-1-yl)-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthrene-3,17-diol

Modify Date: 2025-11-04 09:02:45

(2S,3S,5S,8R,9S,10S,13S,14S,16S,17R)-10,13-dimethyl-2,16-bis(1-methylpiperidin-1-ium-1-yl)-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthrene-3,17-diol Structure
(2S,3S,5S,8R,9S,10S,13S,14S,16S,17R)-10,13-dimethyl-2,16-bis(1-methylpiperidin-1-ium-1-yl)-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthrene-3,17-diol structure
Common Name (2S,3S,5S,8R,9S,10S,13S,14S,16S,17R)-10,13-dimethyl-2,16-bis(1-methylpiperidin-1-ium-1-yl)-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthrene-3,17-diol
CAS Number 43021-46-1 Molecular Weight 488.78900
Density N/A Boiling Point N/A
Molecular Formula C31H56N2O2 Melting Point N/A
MSDS N/A Flash Point N/A

 Names

Name (2S,3S,5S,8R,9S,10S,13S,14S,16S,17R)-10,13-dimethyl-2,16-bis(1-methylpiperidin-1-ium-1-yl)-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthrene-3,17-diol
Synonym More Synonyms

 Chemical & Physical Properties

Molecular Formula C31H56N2O2
Molecular Weight 488.78900
Exact Mass 488.43400
PSA 40.46000
LogP 4.88650
InChIKey LPXWONMTBVUBHC-OBIZLECESA-N
SMILES CC12CC([N+]3(C)CCCCC3)C(O)CC1CCC1C2CCC2(C)C(O)C([N+]3(C)CCCCC3)CC12

 Synonyms

3,17-Hydroxypancuronium
UNII-4713E1J9XJ
3,17-Dihydroxypancuronium
Desdiacetylpancuronium
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