Identité

Difelikefalin Impurity 4

Non indiqué · C21H31N3O4

01Identité

Lazychem ID	LC-43424
CAS RN	Non indiqué
PubChem CID	16408835
Molecular formula	C21H31N3O4
Molecular weight	389.5 g/mol
IUPAC name	(2S)-2-[[1-[(2S)-2-amino-3-phenylpropanoyl]piperidine-4-carbonyl]amino]-4-methylpentanoic acid
InChIKey	OQMPCJGWEHTTPE-ROUUACIJSA-N

02Structure et stéréochimie

Two-dimensional chemical structure of Difelikefalin Impurity 4 — Two-dimensional structure for the PubChem identity linked to this record. Confirm the identifiers before analytical use.

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

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

SMILES	CC(C)C[C@@H](C(=O)O)NC(=O)C1CCN(CC1)C(=O)[C@H](CC2=CC=CC=C2)N
InChI	Non indiqué

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.