Identitet

Molnupiravir Impurity 20

Ikke angivet · C13H19N3O7

01Identitet

Lazychem ID	LC-33540
CAS RN	Ikke angivet
PubChem CID	157931638
Molecular formula	C13H19N3O7
Molecular weight	329.31 g/mol
IUPAC name	[(2R,3S,4R,5R)-3,4-dihydroxy-5-[4-(hydroxyamino)-2-oxopyrimidin-1-yl]oxolan-2-yl]methyl butanoate
InChIKey	UFRPBGZCTRKUTJ-FAQVLOEFSA-N

02Struktur og stereokemi

Two-dimensional chemical structure of Molnupiravir Impurity 20 — 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 4 defined stereocentres. These statements are calculated from the published structure string.

Defined stereocentres	4
Ring count	2
Secondary amines	1
Tertiary amines	0

SMILES	CCCC(=O)OC[C@@H]1[C@H]([C@H]([C@@H](O1)N2C=CC(=NC2=O)NO)O)O
InChI	Ikke angivet

03Stereochemistry

The published structure contains 4 defined and 0 unassigned tetrahedral stereocentres. The exact wedge and dash depiction is shown above.

Defined centres4Structure assigned

Unassigned centres0Structure unspecified

Assignment statusFully assignedExact published identity

Tetrahedral upper bound≤ 16Before 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.