23-Azacholesterol
[CAS# 29588-39-4]

Identification

• Name: 23-Azacholesterol
• Synonyms: (3S,8S,9S,10R,13S,14S)-17-[(1S)-2-(Isobutylamino)-1-Methyl-Ethyl]-10,13-Dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-Dodecahydro-1H-Cyclopenta[A]Phenanthren-3-Ol; (3S,8S,9S,10R,13S,14S)-17-[(1S)-2-(Isobutylamino)-1-Methylethyl]-10,13-Dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-Dodecahydro-1H-Cyclopenta[A]Phenanthren-3-Ol; 23-Azacholesterol
• Molecular Formula: C₂₆H₄₅NO
• Molecular Weight: 387.65
• CAS Registry Number: 29588-39-4
• SMILES: [C@@H]4(CC[C@]2(C(=CC[C@H]3[C@@H]1CCC([C@@H](CNCC(C)C)C)[C@@]1(C)CC[C@H]23)C4)C)O
• InChI: 1S/C26H45NO/c1-17(2)15-27-16-18(3)22-8-9-23-21-7-6-19-14-20(28)10-12-25(19,4)24(21)11-13-26(22,23)5/h6,17-18,20-24,27-28H,7-16H2,1-5H3/t18-,20+,21+,22?,23+,24+,25+,26-/m1/s1
• InChIKey: VEHNVYQXLUWVLW-ZWXYYREYSA-N

Properties

• Density: 1.013g/cm³ (Cal.)
• Boiling point: 487.987°C at 760 mmHg (Cal.)
• Flash point: 16.024°C (Cal.)