AG005XBV

69-52-3 | 4-Thia-1-azabicyclo[3.2.0]heptane-2-carboxylicacid, 6-[[(2R)-2-amino-2-phenylacetyl]amino]-3,3-dimethyl-7-oxo-, sodium salt(1:1), (2S,5R,6R)-

AG005XBV

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CAS Number	69-52-3
Catalog Number	AG005XBV(AGN-PC-0TVZQH)
Chemical Name	4-Thia-1-azabicyclo[3.2.0]heptane-2-carboxylicacid, 6-[[(2R)-2-amino-2-phenylacetyl]amino]-3,3-dimethyl-7-oxo-, sodium salt(1:1), (2S,5R,6R)-
EC Number	200-708-1
IUPAC Name	sodium;(2S,5R,6R)-6-[[(2R)-2-amino-2-phenylacetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate
InChI	InChI=1S/C16H19N3O4S.Na/c1-16(2)11(15(22)23)19-13(21)10(14(19)24-16)18-12(20)9(17)8-6-4-3-5-7-8;/h3-7,9-11,14H,17H2,1-2H3,(H,18,20)(H,22,23);/q;+1/p-1/t9-,10-,11+,14-;/m1./s1
InChI Key	KLOHDWPABZXLGI-YWUHCJSESA-M
MDL Number	MFCD00064313
Molecular Formula	C16H18N3NaO4S
Molecular Weight	371.3866
SMILES	N[C@@H](C(N[C@@H]2C(N3[C@@]([H])2SC(C)(C)[C@@H]3[C@@]([O-])=O)=O)=O)C1=CC=CC=C1.[Na+]
UNII	JFN36L5S8K
Synonyms	Amcill, Aminobenzyl Penicillin, Aminobenzylpenicillin, Ampicillin, Ampicillin Sodium, Ampicillin Trihydrate, Antibiotic KS R1, Antibiotic KS-R1, KS-R1, Antibiotic, Omnipen, Penicillin, Aminobenzyl, Pentrexyl, Polycillin, Sodium, Ampicillin, Trihydrate, Ampicillin, Ukapen, AMPICILLIN SODIUM, Ampicillin sodium salt, 69-52-3, Sodium ampicillin, Ampicillin natrium, Ampicillin (sodium), UNII-JFN36L5S8K, Polycillin-N, Sodium D-(-)-alpha-aminobenzylpenicillin, Totacillin-N, Penbritin-S, Omnipen-N, MFCD00064313, JFN36L5S8K, Domicillin, Citteral, Penialmen, Binotal sodium, Sodium binotal, MLS000028726, Principen/N, D(-)-alpha-Aminobenzylpenicillin sodium salt, Amcill-S, CHEBI:34535, Alpen-N, Sodium P-50, SMR000059229, PEN A/N, Ampicillin Na, Ampicillinsodium, EINECS 200-708-1, Monosodium D-(-)-6-(2-amino-2-phenylacetamido)-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo(3.2.0)heptane-2-carboxylate, Ampiplus Simplex, Sodium amipicillin, AMINOBENZYLPENICILLIN SODIUM SALT, Viccillin (TN), 4-Thia-1-azabicyclo(3.2.0)heptane-2-carboxylic acid, 6-((aminophenylacetyl)amino)-3,3-dimethyl-7-oxo-, monosodium salt, (2S-(2alpha,5alpha,6beta(S*)))-, Monosodium (2S,5R,6R)-6-((R)-2-Amino-2-phenylacetamido)-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo(3.2.0)heptane-2-carboxylate, Prestwick_822, Ampicillin sodium [USAN:USP:JAN], Omnipen-N (TN), D-(-)-alpha-Aminobenzylpenicillin sodium salt, sodium ampicillin(1-), Opera_ID_709, SCHEMBL40521, SPECTRUM1500123, Ampicillin sodium (JP17/USP), CHEMBL1200758, HMS501H08, HY-B0522A, BIA0104, KLOHDWPABZXLGI-YWUHCJSESA-M, ZX-AFC000780, HMS1920C21, HMS2091I21, HMS2232J12, 4-Thia-1-azabicyclo(3.2.0)heptane-2-carboxylic acid, 6-(2-amino-2-phenylacetamido)-3,3-dimethyl-7-oxo-, sodium salt, D-(-)-, degrees +/-UEthCaA(1)EO AAENI, sodium (2S,5R,6R)-6-((R)-2-amino-2-phenylacetamido)-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate, Sodium (2S-(2alpha,5alpha,6beta(S*)))-6-(aminophenylacetamido)-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo(3.2.0)heptane-2-carboxylate, CCG-39691, s3170, AKOS015967315, AKOS025147373, AC-8806, AN-7670, CS-2742, VA10276, CC-24107, K161, Ampicillin sodium salt, cell culture grade, SW220219-1, C13652, D02119, C-21155, Ampicillin Sodium Salt, Antibiotic for Culture Media Use Only, D-(-)-alpha-Aminobenzylpenicillin sodium salt, cell culture grade, 69-52-3,24863-47-6,57748-55-7,69-53-4(freebase), sodium 6beta-[(2R)-2-amino-2-phenylacetamido]-2,2-dimethylpenam-3alpha-carboxylate, (2S,5R,6R)-6-[[(2R)-2-Amino-2-phenylacetyl)amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid sodium salt, 6-(2-amino-2-phenylacetamido)-3,3-dimethyl-7-oxo-,sodiumsalt,d-(-)-4-Thia-1-azabicyclo[3.2.0]heptane-2-carboxylicacid, sodium (2S,5R,6R)-6-[[(2R)-2-amino-2-phenyl-acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate, sodium (2S,5R,6R)-6-{[(2R)-2-amino-2-phenylacetyl]amino}-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate, sodium;(2S,5R,6R)-6-[[(2R)-2-amino-2-phenylacetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate, ampicillin, Totacillin, Austrapen, Penbritin, Pentrexyl, Principen, Binotal, Omnipen, Adobacillin, Ampicilina, Ampicillina, Ampicilline, Ampicillinum, Amplacilina, Amplipenyl, Bonapicillin, Campicillin, Copharcilin, Divercillin, Doktacillin, Duphacillin, Guicitrina, Norobrittin, Orbicilina, Penbristol, Polycillin, Princillin, Racenacillin, Rosampline, Semicillin, Servicillin, Tokiocillin, Totalciclina, Trifacilina, Amblosin, Ampichel, Ampifarm, Ampipenin, Ampiscel, Amplisom, Amplital, Britacil, Delcillin, Geocillin, Grampenil, Lifeampil, Penbrock, Penicline, Pentrexl, Roscillin, Sumipanto, Synpenin, Texcillin, Ultrabion, Ultrabron, Viccillin, Acillin, Amfipen, Ampicil, Ampicin, Ampikel, Ampimed, Ampisyn, Ampivax, Ampivet, Deripen, Morepen, Nuvapen, Penimic, Pentrex, Ponecil, Tolomol, Totapen, Wypicil, Amcill, Amplin, Pensyn, Unasyn, Vampen, Alpen, Cimex, Supen, Ampicillin acid, ampicillin-, Novo-ampicillin, Penbritin syrup, Ampicillin A, D-Ampicillin, Semicillin R, Pfizerpen A, SK-Ampicillin, Viccillin S, Amipenix S, Ampi-bol, Ampy-Penyl, Amfipen V, Pen Ampil, QIDamp, Ampi-Tab, D-Cillin, Olin Kid, Ro-Ampen, Ampi-Co, Ampicillin anhydrate, Penbritin paediatric, Aminobenzylpenicillin, Pen A, Ampicillina [DCIT], D-(-)-Ampicillin, AB-PC Sol, AB-PC, Bayer 5427, AMPICILLINSODIUMSALT, Ampicilina [INN-Spanish], Ampicilline [INN-French], Ampicillinum [INN-Latin], C16H19N3O4S, D-(-)-alpha-Aminopenicillin, C16H19N3O4S.Na, Ampicillin sodium [USAN:JAN], UNII-7C782967RD, HSDB 3009, Penicillin, (aminophenylmethyl)-, D-(-)-alpha-Aminobenzylpenicillin, HI 63, Ampicillin [USAN:BAN:INN:JAN], Ampicillin [USAN:INN:BAN:JAN], BRL 1341, DRG-0074, Ampicillin sodium salt - 25G 25g, C16-H19-N3-O4-S.Na, EINECS 200-709-7, C16-H19-N3-O4-S, CID441087, Ampicillin [USAN:USP:INN:BAN:JAN], AY-6108, BA 7305, CS-O-00900, NSC 528986, NSC-528986, WY-5103, AY 6108, P 50, P-50, SQ 17382, A-7700, EC 200-709-7, 6-[D(-)alpha-aminophenylacetamido]penicillanic acid, 6-(D(-)-alpha-Aminophenylacetamido)penicillanic acid, D-(-)-6-(alpha-Aminophenylacetamido)penicillanic acid, 69-53-4, (2S,5R,6R)-6-((R)-2-Amino-2-phenylacetamido)-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo(3.2.0)heptane-2-carboxylic acid, 4-Thia-1-azabicyclo(3.2.0)heptane-2-carboxylic acid, 6-((aminophenylacetyl)amino)-3,3-dimethyl-7-oxo-, (2S-(2alpha,5alpha,6beta(S*)))-, 4-Thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid, 6-[(aminophenylacetyl)amino]-3,3-dimethyl-7-oxo-, [2S-[2.alpha.,5.alpha.,6.beta.(S*)]]-, 4-Thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid, 6-[(aminophenylacetyl)amino]-3,3-dimethyl-7-oxo-, [2S-[2alpha,5alpha,6beta(S*)]]-, 4-Thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid, 6-[(aminophenylacetyl)amino]-3,3-dimethyl-7-oxo-, monosodium salt, [2S-[2alpha,5alpha,6beta(S*)]]-, 4-Thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid, 6-[(aminophenylacetyl)amino]-3,3-dimethyl-7-oxo-, monosodium salt,[2S-[2.alpha.,5.alpha.,6.beta.(S*)]]-, 4-Thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid, 6-[[(2R)-aminophenylacetyl]amino]-3,3-dimethyl-7-oxo-, (2S,5R,6R)-, 4-Thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid, 6-[[(2R)-aminophenylacetyl]amino]-3,3-dimethyl-7-oxo-, monosodium salt, (2S,5R,6R)-, 6-(D-(2-Amino-2-phenylacetamido))-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo(3.2.0)heptane-2-carboxylic acid, natrium-[2S-[2alpha,5alpha,6beta(S*)]]-6-(aminophenylacetamido)-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptan-2-carboxylat, Sodium [2S-[2alpha,5alpha,6beta(S*)]]-6-(aminophenylacetamido)-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate,

Complexity	568
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	2
Defined Atom Stereocenter Count	4
Defined Bond Stereocenter Count	0
Exact Mass	371.092g/mol
Formal Charge	0
Heavy Atom Count	25
Hydrogen Bond Acceptor Count	6
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	371.387g/mol
Monoisotopic Mass	371.092g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	141A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	6.1
Hazard statements	H317-H334
Packing Group	Ⅲ
Precautionary statements	P261-P280-P342+P311
UN Code	UN 2811

Certificate of Analysis

Lot Number