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17822-79-6

17822-79-6 | Cholest-5-en-1,2-t2-3-ol, (3β)-

CAS No: 17822-79-6 Catalog No: AG0025US MDL No:

Product Description

Catalog Number:
AG0025US
Chemical Name:
Cholest-5-en-1,2-t2-3-ol, (3β)-
CAS Number:
17822-79-6
IUPAC Name:
(3S,8S,9S,10R,13R,14S,17R)-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-1,2-ditritio-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol
InChI:
InChI=1S/C27H46O/c1-18(2)7-6-8-19(3)23-11-12-24-22-10-9-20-17-21(28)13-15-26(20,4)25(22)14-16-27(23,24)5/h9,18-19,21-25,28H,6-8,10-17H2,1-5H3/t19-,21+,22+,23-,24+,25+,26+,27-/m1/s1/i13T,15T/t13?,15?,19-,21+,22+,23-,24+,25+,26+,27-
InChI Key:
HVYWMOMLDIMFJA-OZXVBKCJSA-N

Properties

Complexity:
591  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
8  
Defined Bond Stereocenter Count:
0
Exact Mass:
390.371g/mol
Formal Charge:
0
Heavy Atom Count:
28  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
2  
Molecular Weight:
390.68g/mol
Monoisotopic Mass:
390.371g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
8.7  

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