AG0079ZT

356-12-7 | Pregna-1,4-diene-3,20-dione,21-(acetyloxy)-6,9-difluoro-11-hydroxy-16,17-[(1-methylethylidene)bis(oxy)]-,(6a,11b,16a)-

AG0079ZT

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CAS Number	356-12-7
Catalog Number	AG0079ZT(AGN-PC-0RB4QP)
Chemical Name	Pregna-1,4-diene-3,20-dione,21-(acetyloxy)-6,9-difluoro-11-hydroxy-16,17-[(1-methylethylidene)bis(oxy)]-,(6a,11b,16a)-
EC Number	206-597-6
IUPAC Name	[2-[(1S,2S,4R,8S,9S,11S,12R,13S,19S)-12,19-difluoro-11-hydroxy-6,6,9,13-tetramethyl-16-oxo-5,7-dioxapentacyclo[10.8.0.02,9.04,8.013,18]icosa-14,17-dien-8-yl]-2-oxoethyl] acetate
InChI	InChI=1S/C26H32F2O7/c1-13(29)33-12-20(32)26-21(34-22(2,3)35-26)10-15-16-9-18(27)17-8-14(30)6-7-23(17,4)25(16,28)19(31)11-24(15,26)5/h6-8,15-16,18-19,21,31H,9-12H2,1-5H3/t15-,16-,18-,19-,21+,23-,24-,25-,26+/m0/s1
InChI Key	WJOHZNCJWYWUJD-IUGZLZTKSA-N
MDL Number	MFCD00079302
Molecular Formula	C26H32F2O7
Molecular Weight	494.5249
SMILES	C(COC(C)=O)(=O)[C@]12[C@]3(C)[C@@](C[C@]1(OC(C)(C)O2)[H])([C@]4([C@](F)([C@@H](O)C3)[C@]5(C)C([C@@H](F)C4)=CC(=O)C=C5)[H])[H]
UNII	2W4A77YPAN
Synonyms	Acetonide 21-Acetate, Fluocinolone, FAPG, Fluocinonide, Fluocinolide, Fluocinolone Acetonide 21 Acetate, Fluocinolone Acetonide 21-Acetate, Fluocinonide, Fluocinonide FAPG, Klariderm, Lidemol, Lidex, Lyderm, Metosyn, Novoter, Tiamol, Topsym, Topsyn, Topsyne, fluocinonide, 356-12-7, Lidex, Fluocinolide, Metosyn, Topsyn, Vanos, Fluocinolide acetate, Fluocinolone acetonide acetate, Bestasone, Biscosal, Cortalar, Fluonex, LIDEX-E, Straderm, Topsymin, Lonide, Lyderm, Synalar acetate, Lidex E, Fluocinonido, Fluocinonidum, Fluocinonidum [INN-Latin], Fluocinonide Emulsified Base, Fluocinonido [INN-Spanish], Fluocinolone acetonide 21-acetate, Fluzon, C26H32F2O7, UNII-2W4A77YPAN, Fluocinonide [USAN:BAN:INN:JAN], Fluocinonide(Vanos), Fluocinonide, micronised, EINECS 206-597-6, NSC 101791, 2W4A77YPAN, MLS000028476, 6alpha,9-Difluoro-11beta,16alpha,17,21-tetrahydroxypregna-1,4-diene-3,20-dione, cyclic 16,17-acetal with acetone, 21-acetate, Pregna-1,4-diene-3,20-dione, 21-(acetyloxy)-6,9-difluoro-11-hydroxy-16,17-((1-methylethylidene)bis(oxy))-, (6alpha,11beta,16alpha)-, SMR000058331, Fluocinonide FAPG, DSSTox_CID_25307, DSSTox_RID_80793, DSSTox_GSID_45307, Fluocinomide, Pregna-1,4-diene-3,20-dione, 6-alpha, 9-difluoro-11-beta,16-alpha,17,21-tetrahydroxy-, cyclic17-acetal with acetone, 21-acetate, (6ALPHA,11BETA,16ALPHA)-21-(ACETYLOXY)-6,9-DIFLUORO-11-HYDROXY-16,17-[(1-METHYLETHYLIDENE)BIS(OXY)]-PREGNA-1,4-DIENE-3,20-DIONE, Vanos (TN), Fluocinonide [USAN:INN:BAN:JAN], LIDEX (TN), NCGC00016436-01, CAS-356-12-7, Prestwick_1066, Fluocinonide (Vanos), Fluocinonide(Vanos)/, Fluocinonide [USAN:USP:INN:BAN:JAN], Opera_ID_1780, Prestwick0_000774, Prestwick1_000774, Prestwick2_000774, Prestwick3_000774, FLUOCINOMIDE ACETATE, AC1L1TI1, SCHEMBL4262, CHEMBL1501, BSPBio_000848, SPBio_002787, BPBio1_000934, CHEBI:5109, GTPL7078, DTXSID8045307, Fluocinonide (JP17/USP/INN), Fluocinonide, >=98% (HPLC), HMS1570K10, HMS2097K10, HMS2234H04, HMS3259N05, HMS3714K10, HY-B0485, ZINC3977978, Tox21_110438, ABP000638, MFCD00079302, s2608, AKOS015896516, Tox21_110438_1, AC-2071, API0002731, BCP9000697, CCG-220774, CS-2601, DB01047, NC00621, RL03345, YF10077, FLUOCINONIDE ACETONIDE 21-ACETATE, NCGC00022398-03, NCGC00022398-05, BC214760, Pregna-1,4-diene-3,20-dione, 6alpha,9-difluoro-11beta,16alpha,17,21-tetrahydroxy-, cyclic 16,17-acetal with acetone, 21-acetate, Pregna-1,4-diene-3,20-dione, 6alpha,9-difluoro-11beta,16alpha,17,21-tetrahydroxy-, cyclic 16,17-acetal with acetone, 21-acetate (8CI), SC-78862, Fluonex;Lidex;Lidex-E;Lonide;Lyderm;Vanos, AB2000697, LS-118446, C07007, D00325, 20527-EP2371811A2, 356F127, SR-01000003097, I06-2489, SR-01000003097-3, W-106660, BRD-K57886322-001-03-4, BRD-K57886322-001-12-5, Fluocinonide, United States Pharmacopeia (USP) Reference Standard, 1,4-PREGNADIEN-6ALPHA,9ALPHA-DIFLUORO-11BETA,16ALPHA,17,21-TETROL-3,20-DIONE 16,17-ACETONIDE 21-ACETATE, 2-((2S,6aS,6bR,7S,8aS,8bS,11aR,12aS,12bS)-2,6b-difluoro-7-hydroxy-6a,8a,10,10-tetramethyl-4-oxo-1,2,4,6a,6b,7,8,8a,11a,12,12a,12b-dodecahydro-8bH-naphtho[2',1':4,5]indeno[1,2-d][1,3]dioxol-8b-yl)-2-oxoethyl acetate, 2-[(1S,2S,4R,8S,9S,11S,12R,13S,19S)-12,19-difluoro-11-hydroxy-6,6,9,13-tetramethyl-16-oxo-5,7-dioxapentacyclo[10.8.0.0;{2,9}.0;{4,8}.0;{13,18}]icosa-14,17-dien-8-yl]-2-oxoethyl acetate, Flucinar, flucetonide, Klariderm, Lidemol, Novoter, Topsyne, Tiamol, Topsym, Fluonex (TN), FAPG, Fluocinonide, Lonide (TN), Lyderm (TN), Lidex-E (TN), D03ZZK, Fluocinonide (JP15/USP/INN), CID9642, Fluocinolone Acetonide 21 Acetate, Acetonide 21-Acetate, Fluocinolone, C26-H32-F2-O7, ACN-043406, CS-O-30584, K114, B2144, D005447, Pregna-1,4-diene-3,20-dione, 21-(acetyloxy)-6,9-difluoro-11-hydroxy-16,17-[(1-methylethylidene)bis(oxy)]-, (6.alpha.,11.beta.,16.alpha.)-, Pregna-1,4-dieno-3,20-diona, 21-(acetiloxi)-6,9-difluoro-11-hidroxi-16,17-[(1-metiletilideno)bis(oxi)]-, (6alfa,11beta,16alfa )-,

Complexity	1070
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	9
Defined Bond Stereocenter Count	0
Exact Mass	494.212g/mol
Formal Charge	0
Heavy Atom Count	35
Hydrogen Bond Acceptor Count	9
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	494.532g/mol
Monoisotopic Mass	494.212g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	99.1A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3.2

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	6.1
Hazard statements	H300-H361
Packing Group	Ⅲ
Precautionary statements	P264-P301+P310
UN Code	UN 2811

Certificate of Analysis

Lot Number