CAS 58678-43-6 Isopenicillin N (HCID 440723)

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Basic information

CAS: 58678-43-6
Standard SMILES: CC1(C)S[C@@H]2[C@H](NC(=O)CCC[C@H](N)C(=O)O)C(=O)N2[C@H]1C(=O)O
InChIKey: MIFYHUACUWQUKT-GTQWGBSQSA-N
Molecular formula: C14H21N3O6S
Average molar mass: 359.4 g/mol
Monoisotopic mass: 359.11510639

Overview

Isopenicillin N is a penicillin. It is a conjugate acid of an isopenicillin N(1-).

Names & identifiers

Preferred name: Isopenicillin N
IUPAC: (2S,5R,6R)-6-[[(5S)-5-amino-5-carboxypentanoyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid
English name: Cefmenoxime Impurity 41
Molecular formula: C14H21N3O6S
Molecular weight: 359.4

Names & synonyms

Isopenicillin N58678-43-6CHEBI:18165DTXSID303315166beta-[(5S)-5-amino-5-carboxypentanamido]-2,2-dimethylpenam-3alpha-carboxylic acid6beta-((5S)-5-amino-5-carboxypentanamido)-2,2-dimethylpenam-3alpha-carboxylic acid(2S,5R,6R)-6-(((5S)-5-amino-5-carboxypentanoyl)amino)-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo(3.2.0)heptane-2-carboxylic acid(2S,5R,6R)-6-[[(5S)-5-amino-5-carboxypentanoyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid(2S,5R,6R)-6-{[(5S)-5-amino-5-carboxypentanoyl]amino}-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acidRefChem:149702DTXCID30282610Isopenicilline N

Show more names

Penicillin G Impurity 29Penicillin Impurity 10 (Isopenicillin N)4-Thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid, 6-[[(5S)-5-amino-5-carboxy-1-oxopentyl]amino]-3,3-dimethyl-7-oxo-, (2S,5R,6R)-

(2S,5R,6R)-6-[(5S)-5-amino-5-carboxypentanamido]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acidIP1IsopenicillineNPenicillin MBenzylpenicillin Impurity 29SCHEMBL29573469MIFYHUACUWQUKT-GTQWGBSQSA-NDB03550