AG0039KW

5534-09-8 | (11β,16β)-9-Chloro-11-hydroxy-16-methyl-17,21-bis(1-oxopropoxy)pregna-1,4-diene-3,20-dione

AG0039KW

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CAS Number	5534-09-8
Catalog Number	AG0039KW(AGN-PC-0SJ0B8)
Chemical Name	(11β,16β)-9-Chloro-11-hydroxy-16-methyl-17,21-bis(1-oxopropoxy)pregna-1,4-diene-3,20-dione
EC Number	226-886-0
IUPAC Name	[2-[(8S,9R,10S,11S,13S,14S,16S,17R)-9-chloro-11-hydroxy-10,13,16-trimethyl-3-oxo-17-propanoyloxy-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthren-17-yl]-2-oxoethyl] propanoate
InChI	InChI=1S/C28H37ClO7/c1-6-23(33)35-15-22(32)28(36-24(34)7-2)16(3)12-20-19-9-8-17-13-18(30)10-11-25(17,4)27(19,29)21(31)14-26(20,28)5/h10-11,13,16,19-21,31H,6-9,12,14-15H2,1-5H3/t16-,19-,20-,21-,25-,26-,27-,28-/m0/s1
InChI Key	KUVIULQEHSCUHY-XYWKZLDCSA-N
MDL Number	MFCD00135613
Molecular Formula	C28H37ClO7
Molecular Weight	521.0422
SMILES	CCC(O[C@]1(C(COC(CC)=O)=O)[C@@H](C)C[C@@]2([H])[C@]3([H])CCC4=CC(C=C[C@]4(C)C3(Cl)[C@@H](O)C[C@]12C)=O)=O
UNII	5B307S63B2
Synonyms	Aerobec, AeroBec Forte, Aldecin, Apo-Beclomethasone, Ascocortonyl, Asmabec Clickhaler, Beclamet, Beclazone, Beclazone Easy Breathe, Beclo Asma, Beclo AZU, Beclocort, Becloforte, Beclomet, Beclometasone, Beclomethasone, Beclomethasone Dipropionate, Beclorhinol, Becloturmant, Beclovent, becodisk, Becodisks, Beconase, Beconase AQ, Becotide, Bemedrex Easyhaler, Bronchocort, Dipropionate, Beclomethasone, Ecobec, Filair, Filair Forte, Junik, Nasobec Aqueous, Prolair, Propaderm, Qvar, Respocort, Sanasthmax, Sanasthmyl, Vancenase, Vanceril, Ventolair, Viarin, BECLOMETHASONE DIPROPIONATE, Beclometasone dipropionate, Beconase, Beclovent, 5534-09-8, Vancenase, Beclazone, Becloforte, Beclomet, Beclorhinol, Propaderm, Sanasthmax, Sanasthmyl, Vanceril, Aerobec, Becloturmant, Beclacin, Entyderma, Korbutone, Respocort, Viarox, Rino-clenil, Clenil-A, Beclometasone 17,21-dipropionate, Becotide, Aldecin, Alanase, Aldecina, Aldecine, Atomase, Beclate, Benconase, Rhinosol, Turbinal, Clenil, Spir, Beclocort Nasel, Beclomet Nasal, Propaderm Forte, Rhino Clenil, Inalone O, Inalone R, Qvar, QNASL, Beconase AQ, Qvar 80, Vanceril Double Strength, Becodisks, QVAR 40, CHEBI:3002, UNII-5B307S63B2, KUVIULQEHSCUHY-XYWKZLDCSA-N, SCH 18020W, EINECS 226-886-0, KW-053, 9-Chloro-11beta-hydroxy-16beta-methylpregna-1,4-diene-3,20-dione 17,21-dipropionate, 5B307S63B2, 9-Chloro-11beta,17,21-trihydroxy-16beta-methylpregna-1,4-diene-3,20-dione 17,21-dipropionate, Anceron, Becloval, Viarex, Ventolair, (11beta,16beta)-9-chloro-11-hydroxy-16-methyl-17,21-bis(1-oxopropoxy)pregna-1,4-diene-3,20-dione, [2-[(8S,9R,10S,11S,13S,14S,16S,17R)-9-chloro-11-hydroxy-10,13,16-trimethyl-3-oxo-17-propanoyloxy-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthren-17-yl]-2-oxoethyl] propanoate, 9-chloro-16beta-methyl-11beta,17,21-trihydroxypregna-1,4-diene-3,20-dione 17,21-dipropionate, Pregna-1,4-diene-3,20-dione, 9-chloro-11-hydroxy-16-methyl-17,21-bis(1-oxopropoxy)-, (11beta,16beta)-, Pregna-1,4-diene-3,20-dione, 9-chloro-16-beta-methyl-11-beta,17,21-trihydroxy-, 17,21-dipropionate, C28H37ClO7, Menaderm, MFCD00135613, Beclovent (TN), NCGC00094596-03, Vanceril (TN), CPD001233361, Beclazone 250, Prestwick_990, Qnasl (TN), AC1L2IWA, Beclometasone dipropionato, Prestwick0_000855, Prestwick1_000855, Prestwick2_000855, Prestwick3_000855, beclomethasone-dipropionate, AC1Q62MZ, SCHEMBL6890, DSSTox_CID_28656, DSSTox_RID_82926, Propionic acid beclomethasone, DSSTox_GSID_48730, BSPBio_000869, MLS002154034, SPBio_002790, BPBio1_000957, GTPL5894, CHEMBL1200500, DTXSID3048730, CTK8F7938, Beclomethasone dipropionate (USP), HMS1570L11, HMS2097L11, HMS2235O23, HMS3259H03, HMS3714L11, Beclometasone dipropionate (JP17), Beclomethasone dipropionate [USAN], 9-Chloro-11.beta.,17,21-trihydroxy-16.beta.-methylpregna-1,4-diene-3,20-dione 17,21-dipropionate, Pregna-1,4-diene-3,20-dione, 9-chloro-11-hydroxy-16-methyl-17,21-bis(1-oxopropoxy)-, (11.beta.,16.beta.)-, ZINC3938744, Tox21_113168, HY-13571A, s3078, AKOS015951275, AC-2159, API0001601, CCG-220855, CS-1503, DB00394, NC00610, Beclomethasone dipropionate [USAN:USP], NCGC00179392-01, AN-14214, SMR001233361, CAS-5534-09-8, AB1009261, LS-118439, B4464, ST24046007, C07813, D00689, W-5080, 32278-EP2281815A1, 32278-EP2295408A1, 32278-EP2301933A1, 32278-EP2305640A2, 32278-EP2311827A1, 534B098, BRD-K97810537-001-03-7, BRD-K97810537-001-13-6, Beclomethasone dipropionate, analytical standard, for drug analysis, Beclometasone (beclomethasone) dipropionate, British Pharmacopoeia (BP) Assay Standard, Beclomethasone dipropionate, anhydrous, European Pharmacopoeia (EP) Reference Standard, Beclomethasone Dipropionate, Pharmaceutical Secondary Standard; Certified Reference Material, Beclomethasone dipropionate, United States Pharmacopeia (USP) Reference Standard, (11beta,16beta)-9-chloro-11-hydroxy-16-methyl-3,20-dioxopregna-1,4-diene-17,21-diyl dipropanoate, [(8S,9R,10S,11S,13S,14S,16S,17R)-9-chloro-11-hydroxy-10,13,16-trimethyl-3-oxo-17-(2-propanoyloxyacetyl)-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthren-17-yl] propanoate, [2-[(8S,9R,10S,11S,13S,14S,16S,17R)-9-chloro-11-hydroxy-10,13,16-trimethyl-3-oxo-17-propanoyloxy-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthren-17-yl]-2-oxo-ethyl] propanoate, 2-[(1R,2S,10S,11S,13S,14R,15S,17S)-1-chloro-17-hydroxy-2,13,15-trimethyl-5-oxo-14-(propanoyloxy)tetracyclo[8.7.0.0;{2,7}.0;{11,15}]heptadeca-3,6-dien-14-yl]-2-oxoethyl propanoate, 9-AE-11|A,17,21-EyoC>>u-16|A-(1/4)x>>uOEthcThorn-1,4- paragraph signthornI(c)-3,20- paragraph signthornI feminine-17,21- paragraph signthorn+/-uEao yen, 9-Chloro-11|A,17,21-trihydroxy-16|A-methylpregna-1,4-diene-3,20-dione 17,21-dipropionate, 9-Chloro-11beta, 17,21-trihydroxy-16 beta-methylpregna-1,4-diene-3,20-dione 17,21-dipropionate, Beclometasone dipropionate for peak identification, European Pharmacopoeia (EP) Reference Standard, Beclometasone dipropionate for system suitability, European Pharmacopoeia (EP) Reference Standard, Pregna-1-4-diene-3,20-dione, 9-chloro-16-beta-methyl-11-beta,17,21-trihydroxy-,17,21-dipropionate, beclomethasone, Andion, Beclometasone, Ascocortonyl, Bronchocort, Beclamet, Beclocort, Becodisk, Beconasol, Rhinocort, Inalone, Prolair, Ecobec, Filair, Viarin, Junik, Nasobec Aqueous, Filair Forte, AeroBec Forte, Beclo Asma, Apo-Beclomethasone, Asmabec Clickhaler, Bemedrex Easyhaler, Beclo AZU, Beclazone Easy Breathe, Dipropionate, Beclomethasone, SCH-18020W, CID21700, ACN-036937, CS-O-06168, BECLOMETHASONE DIPROPIONATE MONOHYDRATE, B1248, D001507, Pregna-1,4-diene-3,20-dione, 9-chloro-11,17,21-trihydroxy-16-methyl-, (11beta,16beta)-, 4419-39-0,

Complexity	1050
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	8
Defined Bond Stereocenter Count	0
Exact Mass	520.223g/mol
Formal Charge	0
Heavy Atom Count	36
Hydrogen Bond Acceptor Count	7
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	521.047g/mol
Monoisotopic Mass	520.223g/mol
Rotatable Bond Count	8
Topological Polar Surface Area	107A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H335-H350-H360
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

Lot Number