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14124-61-9 | 2H-Indeno[5,4-f]quinolin-2-one, 1-[2-(dimethylamino)ethyl]-1,3,4,4a,4b,5,6,6a,7,8,9,9a,9b,10-tetradecahydro-7-hydroxy-4a,6a,7-trimethyl-, (4aR,4bS,6aS,7S,9aS,9bR)-
CAS No: 14124-61-9 Catalog No: AG001G56 MDL No:
Product Description
Catalog Number:
AG001G56
Chemical Name:
2H-Indeno[5,4-f]quinolin-2-one, 1-[2-(dimethylamino)ethyl]-1,3,4,4a,4b,5,6,6a,7,8,9,9a,9b,10-tetradecahydro-7-hydroxy-4a,6a,7-trimethyl-, (4aR,4bS,6aS,7S,9aS,9bR)-
CAS Number:
14124-61-9
Molecular Formula:
C23H38N2O2
Molecular Weight:
374.5600
IUPAC Name:
6-[2-(dimethylamino)ethyl]-1-hydroxy-1,9a,11a-trimethyl-2,3,3a,3b,4,8,9,9b,10,11-decahydroindeno[5,4-f]quinolin-7-one
InChI:
InChI=1S/C23H38N2O2/c1-21-11-10-20(26)25(15-14-24(4)5)19(21)7-6-16-17(21)8-12-22(2)18(16)9-13-23(22,3)27/h7,16-18,27H,6,8-15H2,1-5H3
InChI Key:
TZYDTPVLMWSHME-UHFFFAOYSA-N
SMILES:
CN(CCN1C(=O)CC[C@]2(C1=CC[C@@H]1[C@@H]2CC[C@]2([C@H]1CC[C@]2(C)O)C)C)C
Properties
Complexity:
659
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
374.293g/mol
Formal Charge:
0
Heavy Atom Count:
27
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
374.569g/mol
Monoisotopic Mass:
374.293g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
43.8A^2
Undefined Atom Stereocenter Count:
6
Undefined Bond Stereocenter Count:
0
XLogP3:
3
Literature
| Title | Journal |
|---|---|
| Microsphere-based protease assays and screening application for lethal factor and factor Xa. | Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501 |
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