Identita

Protirelin EP Impurity A

CAS 40600-90-6 · C16H22N6O4

01Identita

Lazychem IDLC-26248
CAS RN40600-90-6
PubChem CID21572796
Molecular formulaC16H22N6O4
Molecular weight362.39 g/mol
IUPAC name5-Oxo-L-prolyl-D-histidyl-L-prolinamide
InChIKeyXNSAINXGIQZQOO-TUAOUCFPSA-N

02Struktura a stereochemie

2D structurePubChem CID 21572796
Two-dimensional chemical structure of Protirelin EP Impurity A, CAS 40600-90-6
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 stereocentres3
Ring count3
Secondary amines0
Tertiary amines0
SMILESC1C[C@H](N(C1)C(=O)[C@@H](CC2=CN=CN2)NC(=O)[C@@H]3CCC(=O)N3)C(=O)N
InChINeuvedeno

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

2 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.

Scope: The mathematical 2^n value is only an upper bound. Symmetry and other stereogenic elements can change the number of distinct stereoisomers. A hypothetical configuration is not published as a compound record without a verified structure identity.

04Stav v Indii

Exact-compound status is evaluated only against the published name and CAS number. Confirm the current official instrument before a regulatory decision.

05Názvy a vztahy

API a mateřské léčivo

Protirelin

Nečistoty a související sloučeniny

Názvy a vztahy

  • (2S)-N-[(2R)-1-[(2S)-2-Carbamoylpyrrolidin-1-yl]-3-(1H-imidazol-5-yl)-1-oxopropan-2-yl]-5-oxopyrrolidine-2-carboxamide
  • (S)-N-((R)-1-((S)-2-Carbamoylpyrrolidin-1-yl)-3-(1H-imidazol-4-yl)-1-oxopropan-2-yl)-5-oxopyrrolidine-2-carboxamide

Nečistoty a související sloučeniny

06Zdroje