Identita

Atorvastatin Impurity 185

Neuvedeno · C34H37FN2O5

01Identita

Lazychem ID	LC-39738
CAS RN	Neuvedeno
PubChem CID	58300464
Molecular formula	C34H37FN2O5
Molecular weight	572.7 g/mol
IUPAC name	(5R)-7-[2-(4-fluorophenyl)-3-phenyl-4-(phenylcarbamoyl)-5-propan-2-ylpyrrol-1-yl]-5-hydroxy-3-methoxyheptanoic acid
InChIKey	WXRUMNYOLOVRFD-QXPUDEPPSA-N

02Struktura a stereochemie

Two-dimensional chemical structure of Atorvastatin Impurity 185 — 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 1 defined stereocentre, contains at least one halogen atom. These statements are calculated from the published structure string.

Defined stereocentres	1
Ring count	4
Secondary amines	0
Tertiary amines	0

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

03Stereochemistry

The published structure contains 1 defined and 1 unassigned tetrahedral stereocentres. The exact wedge and dash depiction is shown above.

Defined centres1Structure assigned

Unassigned centres1Structure unspecified

Assignment statusPartially assignedExact published identity

Tetrahedral upper bound≤ 4Before symmetry reduction

Published same-connectivity configurations

3 records

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.