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4642-50-6

4642-50-6 | Spiro[5α-androstane-3,2'-thiazolidine]

CAS No: 4642-50-6 Catalog No: AG00DZWU MDL No:

Product Description

Catalog Number:
AG00DZWU
Chemical Name:
Spiro[5α-androstane-3,2'-thiazolidine]
CAS Number:
4642-50-6
IUPAC Name:
(5S,8S,9S,10S,13S,14S)-10,13-dimethylspiro[1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthrene-3,2'-1,3-thiazolidine]
InChI:
InChI=1S/C21H35NS/c1-19-8-3-4-17(19)16-6-5-15-14-21(22-12-13-23-21)11-10-20(15,2)18(16)7-9-19/h15-18,22H,3-14H2,1-2H3/t15-,16-,17-,18-,19-,20-,21?/m0/s1
InChI Key:
JVXHNDBFKXFHCI-YTAPOSPOSA-N

Properties

Complexity:
492  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
6  
Defined Bond Stereocenter Count:
0
Exact Mass:
333.249g/mol
Formal Charge:
0
Heavy Atom Count:
23  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
333.578g/mol
Monoisotopic Mass:
333.249g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
6.5  

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