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Ertapenem-[d4] Disodium

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General Information
Catalog: BLP-012343
CAS: 1356934-56-9
Molecular Formula: C22H19D4N3Na2O7S
Molecular Weight: 523.50

Chemical Structure

Description	Ertapenem-[d4] Disodium is the labelled analogue of Ertapenem, which is a carbapenem antibiotic medication.
Synonyms	Ertapenem-d4 Disodium
IUPAC Name	disodium;(4R,5S,6S)-3-[(3S,5S)-5-[(3-carboxylato-2,4,5,6-tetradeuteriophenyl)carbamoyl]pyrrolidin-3-yl]sulfanyl-6-[(1R)-1-hydroxyethyl]-4-methyl-7-oxo-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate
Related CAS	153832-38-3 (unlabelled)
Canonical SMILES	CC1C2C(C(=O)N2C(=C1SC3CC(NC3)C(=O)NC4=CC=CC(=C4)C(=O)[O-])C(=O)[O-])C(C)O.[Na+].[Na+]
InChI	InChI=1S/C22H25N3O7S.2Na/c1-9-16-15(10(2)26)20(28)25(16)17(22(31)32)18(9)33-13-7-14(23-8-13)19(27)24-12-5-3-4-11(6-12)21(29)30;;/h3-6,9-10,13-16,23,26H,7-8H2,1-2H3,(H,24,27)(H,29,30)(H,31,32);;/q;2*+1/p-2/t9-,10-,13+,14+,15-,16-;;/m1../s1/i3D,4D,5D,6D;;
InChI Key	KMVRATCHVMUJHM-HZCFKPICSA-L
Storage	Store at -20°C