Identità

Atorvastatin Impurity 199

Mhux elenkat · C33H35FN2O5

01Identità

Lazychem ID	LC-34069
CAS RN	Mhux elenkat
PubChem CID	145714530
Molecular formula	C33H35FN2O5
Molecular weight	558.6 g/mol
IUPAC name	(3R,5R)-7-[2-(3-fluorophenyl)-3-phenyl-4-(phenylcarbamoyl)-5-propan-2-ylpyrrol-1-yl]-3,5-dihydroxyheptanoic acid
InChIKey	ZQFFKRVNVDDRJL-KAYWLYCHSA-N

02Struttura u stereokimika

Two-dimensional chemical structure of Atorvastatin Impurity 199 — Two-dimensional structure for the PubChem identity linked to this record. Confirm the identifiers before analytical use.

The parsed structure contains 4 rings, includes aromatic atoms, includes aliphatic carbon, has 2 defined stereocentres, contains at least one halogen atom. These statements are calculated from the published structure string.

Defined stereocentres	2
Ring count	4
Secondary amines	0
Tertiary amines	0

SMILES	CC(C)C1=C(C(=C(N1CC[C@H](C[C@H](CC(=O)O)O)O)C2=CC(=CC=C2)F)C3=CC=CC=C3)C(=O)NC4=CC=CC=C4
InChI	Mhux elenkat

03Stereochemistry

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

Defined centres2Structure assigned

Unassigned centres0Structure unspecified

Assignment statusFully assignedExact 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.