Ταυτότητα

Ceftaroline Impurity 14

Δεν αναφέρεται · C29H26N2O7S2

01Ταυτότητα

Lazychem ID	LC-48062
CAS RN	Δεν αναφέρεται
PubChem CID	9851197
Molecular formula	C29H26N2O7S2
Molecular weight	578.7 g/mol
IUPAC name	benzhydryl 3-methylsulfonyloxy-8-oxo-7-[(2-phenylacetyl)amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate
InChIKey	NWRAKIYILKAIFB-UHFFFAOYSA-N

02Δομή και στερεοχημεία

Two-dimensional chemical structure of Ceftaroline Impurity 14 — Two-dimensional structure for the PubChem identity linked to this record. Confirm the identifiers before analytical use.

The parsed structure contains 5 rings, includes aromatic atoms, includes aliphatic carbon. These statements are calculated from the published structure string.

Defined stereocentres	0
Ring count	5
Secondary amines	0
Tertiary amines	0

SMILES	CS(=O)(=O)OC1=C(N2C(C(C2=O)NC(=O)CC3=CC=CC=C3)SC1)C(=O)OC(C4=CC=CC=C4)C5=CC=CC=C5
InChI	Δεν αναφέρεται

03Stereochemistry

The published structure contains 0 defined and 2 unassigned tetrahedral stereocentres. The exact wedge and dash depiction is shown above.

Defined centres0Structure assigned

Unassigned centres2Structure unspecified

Assignment statusUnassignedExact published identity

Tetrahedral upper bound≤ 4Before 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.