AG00IGWE

91832-40-5 | (6R,7R)-7-[[(2Z)-2-(2-Amino-4-thiazolyl)-2-(hydroxyimino)acetyl]amino]-3-ethenyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid

AG00IGWE

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CAS Number	91832-40-5
Catalog Number	AG00IGWE(AGN-PC-0VW7UP)
Chemical Name	(6R,7R)-7-[[(2Z)-2-(2-Amino-4-thiazolyl)-2-(hydroxyimino)acetyl]amino]-3-ethenyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
IUPAC Name	(6R,7R)-7-[[(2Z)-2-(2-amino-1,3-thiazol-4-yl)-2-hydroxyiminoacetyl]amino]-3-ethenyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
InChI	InChI=1S/C14H13N5O5S2/c1-2-5-3-25-12-8(11(21)19(12)9(5)13(22)23)17-10(20)7(18-24)6-4-26-14(15)16-6/h2,4,8,12,24H,1,3H2,(H2,15,16)(H,17,20)(H,22,23)/b18-7-/t8-,12-/m1/s1
InChI Key	RTXOFQZKPXMALH-GHXIOONMSA-N
MDL Number	MFCD28900275
Molecular Formula	C14H13N5O5S2
Molecular Weight	395.4135
NSC Number	758926
SMILES	C(=O)(O)C1=C(C=C)CS[C@H]2N1C(=O)[C@H]2NC(=O)/C(=NO)/c1csc(n1)N
UNII	CI0FAO63WC
Synonyms	7-(2 (2-aminothiazol-4-yl)-2-hydroxyiminoacetamido)-3-vinyl-3-cephem-4-carboxylic acid, cefdinir, CI 983, CI-983, CI983, FK 482, FK-482, FK482, Omnicef, PD 134393, PD-134393, cefdinir, 91832-40-5, Omnicef, CFDN, Cefdinirum, Cefdinyl, Cefzon, CI-983, FK-482, Cefdirnir, FK 482, Cefdinirum [INN-Latin], UNII-CI0FAO63WC, BMY 28488, CI 983, Cefdinir (Omnicef), PD 134393, PD-134393, CI0FAO63WC, CHEBI:3485, BMY-28488, (-)-(6R,7R)-7-(2-(2-Amino-4-thiazolyl)glyoxylamido)-8-oxo-3-vinyl-5-thia-1-azabicyclo(4.2.0)oct-2-ene-2-carboxylic acid, 7(sup 2)-(Z)-oxime, (6R,7R)-7-[[(2Z)-2-(2-amino-1,3-thiazol-4-yl)-2-hydroxyiminoacetyl]amino]-3-ethenyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid, C14H13N5O5S2, Cefdinir(Omnicef), Ceftinex, Cefdinir [USAN:INN], 5-Thia-1-azabicyclo(4.2.0)oct-2-ene-2-carboxylic acid, 7-(((2-amino-4-thiazolyl) (hydroxyimino)acetyl)amino)-3-ethenyl-8-oxo-, (6R-(6alpha,7beta(Z)))-, 5-Thia-1-azabicyclo(4.2.0)oct-2-ene-2-carboxylic acid, 7-(((2-amino-4-thiazolyl)(hydroxyiminoacetyl)amino)-3-ethenyl-8-oxo-, (6R-(6-alpha,7-beta(Z)))-, Omnicef (TN), Cefzon (TN), SR-05000001991, Cefdinir [USAN:USP:INN:BAN], Cefdinir(Omnicef)/, Cefdinir, 97%, PubChem13658, FR-80482, AC1OCD3C, Spectrum5_001560, CHEMBL927, 7-(2 (2-aminothiazol-4-yl)-2-hydroxyiminoacetamido)-3-vinyl-3-cephem-4-carboxylic acid, SCHEMBL36995, BSPBio_002735, MLS001304703, MLS001424233, BIDD:GT0827, SPECTRUM1505208, Cefdinir (JP17/USAN/INN), DTXSID8046084, cid_6915944, BCPP000293, HMS1922L19, HMS2093K20, HMS3715F07, Pharmakon1600-01505208, (6R,7R)-7-((Z)-2-(2-aminothiazol-4-yl)-2-(hydroxyimino)acetamido)-8-oxo-3-vinyl-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid, HY-B0136, ABP000637, CCG-39455, MFCD00865030, NSC758926, s1605, ZINC13119676, AKOS015951262, AKOS032960348, BCP9000503, CS-1925, DB00535, NSC-758926, NCGC00178499-01, (6R,7R)-7-{[(2Z)-2-(2-amino-1,3-thiazol-4-yl)-2-(hydroxyimino)acetyl]amino}-3-ethenyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid, 7beta-[(2Z)-2-(2-amino-1,3-thiazol-4-yl)-2-(hydroxyimino)acetamido]-3-ethenyl-3,4-didehydrocepham-4-carboxylic acid, AN-15138, AS-35316, CPD000469224, SAM001246818, SC-17007, SBI-0206739.P001, AB1009352, LS-149988, ST24046294, C08110, D00917, X-2542, AB01274720-01, AB01274720_02, AB01274720_03, Cefdinir, Antibiotic for Culture Media Use Only, 832C405, A844075, SR-05000001991-1, SR-05000001991-2, BRD-K15766189-001-05-6, (6R,7R)-7-[(2Z)-2-(2-amino-1,3-thiazol-4-yl)-2-(N-hydroxyimino)acetamido]-3-ethenyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid, (6R,7R)-7-[[(2Z)-2-(2-amino-4-thiazolyl)-2-hydroxyimino-1-oxoethyl]amino]-3-ethenyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid, (6R,7R)-7-[[(2Z)-2-(2-aminothiazol-4-yl)-2-hydroxyimino-acetyl]amino]-8-oxo-3-vinyl-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid, (6R,7R)-7-[[(2Z)-2-(2-azanyl-1,3-thiazol-4-yl)-2-hydroxyimino-ethanoyl]amino]-3-ethenyl-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid, (6R,7R)-7-{2-(2-Amino-thiazol-4-yl)-2-[(Z)-hydroxyimino]-acetylamino}-8-oxo-3-vinyl-5-thia-1-aza-bicyclo[4.2.0]oct-2-ene-2-carboxylic acid, (6R,7R,Z)-7-(2-(2-aminothiazol-4-yl)-2-(hydroxyimino)acetamido)-8-oxo-3-vinyl-5-thia-1-aza-bicyclo[4.2.0]oct-2-ene-2-carboxylic acid, (7R)-3-Vinyl-7-[[(2-amino-4-thiazolyl)[(E)-hydroxyimino]acetyl]amino]cepham-3-ene-4-carboxylic acid, 5-Thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid, 7-[[(2Z)-2-(2-amino-4-thiazolyl)-2-(hydroxyimino)acetyl]amino]-3-ethenyl-8-oxo-, (6R,7R)-, syn-7-[2-(2-Amino-4-thiazolyl)-2-hydroxyiminoacetamido]-3-vinyl-3-cephem-4-carboxylic acid; [6R-[6|A-7|A(Z)]]-7-[[(2-Amino-4-thiazolyl)(hydroxyimino)acetyl]amino]-3-ethenyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid, cefnil, Cefdiel, Cefdinir monohydrate, D0WS1X, MLS001165672, Cefdinir (JP15/USAN/INN), CI983, FK482, C14-H13-N5-O5-S2, CID6915944, KS-1038, SMR000469224, A8391, C3111, A10187, C-2466, C056814, D000077525, Omnicef, FK-482, BMY-28488, PD 134393, CI-983, Cefdinir, syn-7-[2-(2-amino-4-thiazolyl)-2-hydroxyiminoacetamido]-3-vinyl-3-cephem-4-carboxylic acid, 5-Thia-1-azabicyclo(4.2.0)oct-2-ene-2-carboxylic acid, 7-(((2Z)-2-(2-amino-4-thiazolyl)-2-(hydroxyimino)-1-oxoethyl)amino)-3-ethenyl-8-oxo-, (6R,7R)-,

Complexity	739
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	2
Defined Bond Stereocenter Count	1
Exact Mass	395.036g/mol
Formal Charge	0
Heavy Atom Count	26
Hydrogen Bond Acceptor Count	10
Hydrogen Bond Donor Count	4
Isotope Atom Count	0
Molecular Weight	395.408g/mol
Monoisotopic Mass	395.036g/mol
Rotatable Bond Count	5
Topological Polar Surface Area	212A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

Lot Number