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Benzyl Penicillinate-[d7] Potassium Salt

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General Information
Catalog: BLP-003433
CAS: 352323-25-2
Molecular Formula: C16H10D7KN2O4S
Molecular Weight: 379.52

Chemical Structure

Description	Benzyl Penicillinate-[d7] Potassium Salt is an isotope form of Benzyl Penicillinate Potassium Salt. Penicillin G potassium is a fast-acting antibiotic, used to treat bacterial infections that affect the blood, heart, lungs, joints, and genital areas.
Synonyms	(2S,5R,6R)-3,3-Dimethyl-7-oxo-6-[(2-phenylacetyl)amino]-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic Acid-d7 Potassium Salt; Penicillin G-d7 Potassium Salt; Benzylpenicillin-d7 Potassium; Notaral-d7; Pentids-d7; Potassium 6-(Phenylacetamido)penicillanate-d7; Potassium Benzylpenicillin-d7; Potassium Benzylpenicillinate-d7
IUPAC Name	potassium;(2S,5R,6R)-6-[[2,2-dideuterio-2-(2,3,4,5,6-pentadeuteriophenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate
Related CAS	113-98-4 (unlabelled)
Isomeric SMILES	[2H]C1=C(C(=C(C(=C1[2H])[2H])C([2H])([2H])C(=O)N[C@H]2[C@@H]3N(C2=O)[C@H](C(S3)(C)C)C(=O)[O-])[2H])[2H].[K+]
Canonical SMILES	CC1(C(N2C(S1)C(C2=O)NC(=O)CC3=CC=CC=C3)C(=O)[O-])C.[K+]
InChI	InChI=1S/C16H18N2O4S.K/c1-16(2)12(15(21)22)18-13(20)11(14(18)23-16)17-10(19)8-9-6-4-3-5-7-9;/h3-7,11-12,14H,8H2,1-2H3,(H,17,19)(H,21,22);/q;+1/p-1/t11-,12+,14-;/m1./s1/i3D,4D,5D,6D,7D,8D2;
InChI Key	IYNDLOXRXUOGIU-RSWIJXEESA-M
Melting Point	218-220°C
Purity	> 98%
Solubility	Soluble in DMSO, Methanol, Water
Appearance	White Solid
Storage	-20°C