Identiteet

Ampicillin Impurity 79

Pole loetletud · C15H16N2O4S

01Identiteet

Lazychem ID	LC-51562
CAS RN	Pole loetletud
PubChem CID	209816
Molecular formula	C15H16N2O4S
Molecular weight	320.4 g/mol
IUPAC name	(2S,5R,6R)-6-benzamido-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid
InChIKey	LWLBKAXKNGTFAY-GBIKHYSHSA-N

02Struktuur ja stereokeemia

Two-dimensional chemical structure of Ampicillin Impurity 79 — Two-dimensional structure for the PubChem identity linked to this record. Confirm the identifiers before analytical use.

The parsed structure contains 3 rings, includes aromatic atoms, includes aliphatic carbon, has 3 defined stereocentres. These statements are calculated from the published structure string.

Defined stereocentres	3
Ring count	3
Secondary amines	0
Tertiary amines	0

SMILES	CC1([C@@H](N2[C@H](S1)[C@@H](C2=O)NC(=O)C3=CC=CC=C3)C(=O)O)C
InChI	Pole loetletud

03Stereochemistry

The published structure contains 3 defined and 0 unassigned tetrahedral stereocentres. The exact wedge and dash depiction is shown above.

Defined centres3Structure assigned

Unassigned centres0Structure unspecified

Assignment statusFully assignedExact published identity

Tetrahedral upper bound≤ 8Before symmetry reduction

Published same-connectivity configurations

1 record

These records have the same connectivity, molecular formula and protonation layer, but a different complete InChIKey stereochemical layer. Only separately structure-linked records are shown.