AG000E36

1173-26-8 | 2-((8S,9S,10R,11S,13S,14S,17S)-11-Hydroxy-10,13-dimethyl-3-oxo-2,3,6,7,8,9,10,11,12,13,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl)-2-oxoethyl acetate

AG000E36

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CAS Number	1173-26-8
Catalog Number	AG000E36(AGN-PC-0NZ8SZ)
Chemical Name	2-((8S,9S,10R,11S,13S,14S,17S)-11-Hydroxy-10,13-dimethyl-3-oxo-2,3,6,7,8,9,10,11,12,13,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl)-2-oxoethyl acetate
EC Number	214-635-8
IUPAC Name	[2-[(8S,9S,10R,11S,13S,14S,17S)-11-hydroxy-10,13-dimethyl-3-oxo-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-17-yl]-2-oxoethyl] acetate
InChI	InChI=1S/C23H32O5/c1-13(24)28-12-20(27)18-7-6-17-16-5-4-14-10-15(25)8-9-22(14,2)21(16)19(26)11-23(17,18)3/h10,16-19,21,26H,4-9,11-12H2,1-3H3/t16-,17-,18+,19-,21+,22-,23-/m0/s1
InChI Key	WKQCPUMQBMFPLC-ZWFCQKKLSA-N
MDL Number	MFCD00010482
Molecular Formula	C23H32O5
Molecular Weight	388.4972
NSC Number	81764
SMILES	CC(=O)OCC(=O)[C@H]1CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3[C@@H](O)C[C@]12C
UNII	KN17U0V6BL
Synonyms	corticosterone acetate, Corticosterone 21-acetate, 1173-26-8, Cort A, Corticosterone acetate, UNII-KN17U0V6BL, SKF 5654, NSC 81764, CORTICOSTERONE, 21-ACETATE, KN17U0V6BL, 11beta,21-Dihydroxypregn-4-ene-3,20-dione 21-acetate, Pregn-4-ene-3,20-dione, 21-(acetyloxy)-11-hydroxy-, (11b)-, EINECS 214-635-8, BRN 3225312, 11-beta,21-Dihydroxypregn-4-ene-3,20-dione acetate, CORTICOSTERONE-21-ACETATE, Pregn-4-ene-3,20-dione, 11beta,21-dihydroxy-, 21-acetate, Pregn-4-ene-3,20-dione, 11-beta,21-dihydroxy-, 21-acetate, Pregn-4-ene-3,20-dione, 21-(acetyloxy)-11-hydroxy-, (11.beta.)-, 2-((8S,9S,10R,11S,13S,14S,17S)-11-Hydroxy-10,13-dimethyl-3-oxo-2,3,6,7,8,9,10,11,12,13,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl)-2-oxoethyl acetate, AC1L5TBE, 21-O-Acetyl-corticosterone, 11.beta.,20-dione acetate, SCHEMBL635203, Pregn-4-ene-3,20-dione,21-(acetyloxy)-11-hydroxy-, (11b)-, CHEBI:34141, CTK8B3004, WKQCPUMQBMFPLC-ZWFCQKKLSA-N, [2-[(8S,9S,10R,11S,13S,14S,17S)-11-hydroxy-10,13-dimethyl-3-oxo-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-17-yl]-2-oxoethyl] acetate, NSC81764, ZINC4896919, ANW-41580, MFCD00010482, NSC-81764, AKOS025294137, API0002114, TR-031786, C14675, A803750, 4-Pregnen-11.beta.,21-diol-3,20-dione-21-acetate, WLN: L E5 B666 OV MUTJ A1 CQ E1 FV1OV1, 11.beta.,21-Dihydroxypregn-4-ene-3,20-dione acetate, 11beta,21-Dihydroxy-4-pregnene-3,20-dione 21-acetate, Pregn-4-ene-3, 11.beta.,21-dihydroxy-, 21-acetate, Corticosterone 21-acetate, VETRANAL(TM), analytical standard, Pregn-4-ene-3, 21-(acetyloxy)-11-hydroxy-, (11.beta.)-, 11-Hydroxy-3,20-dioxopregn-4-en-21-yl acetate, (11.beta.)-, Pregn-4-ene-3,20-dione, 11.beta.,21-dihydroxy-, 21-acetate, Pregn-4-ene-3,20-dione, 21-(acetyloxy)-11-hydroxy-, (11beta)-, Pregn-4-ene-3,20-dione, 21-(acetyloxy)-11-hydroxy-, (11-beta)- (9CI), [2-[(8S,9S,10R,11S,13S,14S,17S)-10,13-dimethyl-11-oxidanyl-3-oxidanylidene-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-17-yl]-2-oxidanylidene-ethyl] ethanoate, 2-((8S,9S,10R,11S,13S,14S,17S)-11-Hydroxy-10,13-dimethyl-3-oxo-2,3,6,7,8,9,10,11,12,13,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthr, acetic acid [2-[(8S,9S,10R,11S,13S,14S,17S)-11-hydroxy-10,13-dimethyl-3-oxo-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-17-yl]-2-oxoethyl] ester, C23H32O5, AR-1I2713, CID255846, C23-H32-O5, C1479, 4-08-00-02907 (Beilstein Handbook Reference), C029939, Pregn-4-ene-3,20-dione, 21-(acetyloxy)-11-hydroxy-, (11-beta)-(9ci, 117606-17-4,

Complexity	739
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	7
Defined Bond Stereocenter Count	0
Exact Mass	388.225g/mol
Formal Charge	0
Heavy Atom Count	28
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	388.504g/mol
Monoisotopic Mass	388.225g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	80.7A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.5

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H317
Packing Group
Precautionary statements	P261-P280
UN Code

Certificate of Analysis

Lot Number