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6871-55-2 | (3R)-1,2,3,3aα,4,5,6,6aβ,7,7aβ,8,9,10,12aα-Tetradecahydro-3β-hydroxy-5α-methyl-11H-pyrido[1',2'
CAS No: 6871-55-2 Catalog No: AG00FV0Y MDL No:
Product Description
Catalog Number:
AG00FV0Y
Chemical Name:
(3R)-1,2,3,3aα,4,5,6,6aβ,7,7aβ,8,9,10,12aα-Tetradecahydro-3β-hydroxy-5α-methyl-11H-pyrido[1',2'
CAS Number:
6871-55-2
IUPAC Name:
(1S,7S,9R,11R,13R,14R)-14-hydroxy-11-methyl-2,17-diazatetracyclo[7.7.1.02,7.013,17]heptadecan-3-one
InChI:
InChI=1S/C16H26N2O2/c1-10-7-12-9-11-3-2-4-16(20)18(11)15-6-5-14(19)13(8-10)17(12)15/h10-15,19H,2-9H2,1H3/t10-,11+,12-,13-,14-,15+/m1/s1
InChI Key:
IPJWEZOVCXECOG-FVUFVHQMSA-N
Properties
Complexity:
413
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
6
Defined Bond Stereocenter Count:
0
Exact Mass:
278.199g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
278.396g/mol
Monoisotopic Mass:
278.199g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
43.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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