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124478-41-7 | 18,19-Dinorpregn-4-en-20-yn-17-ol, 13-ethyl-, (17α)-, mixt. with (17α)-3-(cyclopentyloxy)-19-norpregna-1,3,5(10)-trien-20-yn-17-ol (9CI)
CAS No: 124478-41-7 Catalog No: AG000M2U MDL No:
Product Description
Catalog Number:
AG000M2U
Chemical Name:
18,19-Dinorpregn-4-en-20-yn-17-ol, 13-ethyl-, (17α)-, mixt. with (17α)-3-(cyclopentyloxy)-19-norpregna-1,3,5(10)-trien-20-yn-17-ol (9CI)
CAS Number:
124478-41-7
IUPAC Name:
13-ethyl-17-ethynyl-2,3,6,7,8,9,10,11,12,14,15,16-dodecahydro-1H-cyclopenta[a]phenanthren-17-ol
InChI:
InChI=1S/C21H30O/c1-3-20-13-11-17-16-8-6-5-7-15(16)9-10-18(17)19(20)12-14-21(20,22)4-2/h2,7,16-19,22H,3,5-6,8-14H2,1H3
InChI Key:
MXXKGWYLIJQEBP-UHFFFAOYSA-N
Properties
Complexity:
537
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
298.23g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
298.47g/mol
Monoisotopic Mass:
298.23g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
6
Undefined Bond Stereocenter Count:
0
XLogP3:
4.9
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