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4-[(9S,14S,17R)-10,13-dimethyl-3,7,12-trioxo-1,2,4,5,6,8,9,11,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-17-yl]pentanoate; 2-hydroxyethyl-trimethyl-azanium (4201-78-9)

Identification
Name:4-[(9S,14S,17R)-10,13-dimethyl-3,7,12-trioxo-1,2,4,5,6,8,9,11,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-17-yl]pentanoate; 2-hydroxyethyl-trimethyl-azanium
Synonyms:(2-hydroxyethyl)trimethylammonium (5beta)-3,7,12-trioxocholan-24-oate
CAS:4201-78-9
EINECS: 224-106-3
Molecular Formula: C29H47NO6
Molecular Weight: 505.68658
InChI: InChI=1/C24H34O5.C5H14NO/c1-13(4-7-21(28)29)16-5-6-17-22-18(12-20(27)24(16,17)3)23(2)9-8-15(25)10-14(23)11-19(22)26;1-6(2,3)4-5-7/h13-14,16-18,22H,4-12H2,1-3H3,(H,28,29);7H,4-5H2,1-3H3/q;+1/p-1/t13?,14?,16-,17+,18+,22?,23?,24?;/m1./s1
Molecular Structure: (C29H47NO6) (2-hydroxyethyl)trimethylammonium (5beta)-3,7,12-trioxocholan-24-oate
Properties
Flash Point: 319.5°C
Boiling Point: 581.5°C at 760 mmHg
Flash Point: 319.5°C
Safety Data
 

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