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22-Thiacholesterol
[CAS# 94156-75-9]

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CAS#: 94156-75-9
Product: 22-Thiacholesterol
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Identification
Name 22-Thiacholesterol
Synonyms (3S,8S,9S,10R,13S,14S,17S)-17-[(1R)-1-Isopentylsulfanylethyl]-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,17S)-17-[(1R)-1-(Isopentylthio)Ethyl]-10,13-Dimethyl-2,3,4,7,8,9,11,12,14,15,16,1
Molecular Structure CAS#: 94156-75-9, 22-Thiacholesterol
Molecular Formula C26H44OS
Molecular Weight 404.69
CAS Registry Number 94156-75-9
SMILES [C@@H]4([C@@H](C)SCCC(C)C)[C@@]3([C@H]([C@@H]2CC=C1C[C@H](CC[C@@]1([C@H]2CC3)C)O)CC4)C
InChI 1S/C26H44OS/c1-17(2)12-15-28-18(3)22-8-9-23-21-7-6-19-16-20(27)10-13-25(19,4)24(21)11-14-26(22,23)5/h6,17-18,20-24,27H,7-16H2,1-5H3/t18-,20+,21+,22-,23+,24+,25+,26-/m1/s1
InChIKey LHCQLAFJKZXZJJ-XSLNCIIRSA-N
Properties
Density 1.04g/cm3 (Cal.)
Boiling point 507.317°C at 760 mmHg (Cal.)
Flash point 245.925°C (Cal.)
Market Analysis Reports
List of Reports Available for 22-Thiacholesterol
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