Tachysterol
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Tachysterol
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CAS No:
115-61-7
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Formula:
C28H44O
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Chemical Name:
Tachysterol
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Synonyms:
3-Cyclohexen-1-ol,3-[(1E)-2-[(1R,3aR,7aR)-2,3,3a,6,7,7a-hexahydro-7a-methyl-1-[(1R,2E,4R)-1,4,5-trimethyl-2-hexen-1-yl]-1H-inden-4-yl]ethenyl]-4-methyl-,(1S)-;Tachysterol;9,10-Secoergosta-5(10),6,8,22-tetraen-3-ol,(3β,6E,22E)-;(1S)-3-[(1E)-2-[(1R,3aR,7aR)-2,3,3a,6,7,7a-Hexahydro-7a-methyl-1-[(1R,2E,4R)-1,4,5-trimethyl-2-hexen-1-yl]-1H-inden-4-yl]ethenyl]-4-methyl-3-cyclohexen-1-ol;Provitamin D;Tachysterol2;Tachysterin2
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CAS No:
Characteristics
20.2
7.64100
0.9784 (rough estimate)
<25 °C
460.3°C (rough estimate)
218.1ºC
1.5100 (estimate)
D18 -70° (24.6 mg in 2 ml petr ether); 18546 -86.3° (petr ether)
Tachysterol Use and Manufacturing
Bioactive, synthetic vitamin D3 analog; exhibits antiproliferative effect on keratinocytes. Antipsoriatic.
Computed Properties
Molecular Weight:396.6
XLogP3:7.2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:6
Exact Mass:396.339216023
Monoisotopic Mass:396.339216023
Topological Polar Surface Area:20.2
Heavy Atom Count:29
Complexity:691
Undefined Atom Stereocenter Count:6
Undefined Bond Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes