Identiteit

Molnupiravir Impurity 19

Niet vermeld · C21H31N3O9

01Identiteit

Lazychem ID	LC-34152
CAS RN	Niet vermeld
PubChem CID	142604166
Molecular formula	C21H31N3O9
Molecular weight	469.5 g/mol
IUPAC name	[(2R,3R,4R,5R)-5-[4-(hydroxyamino)-2-oxopyrimidin-1-yl]-3,4-bis(2-methylpropanoyloxy)oxolan-2-yl]methyl 2-methylpropanoate
InChIKey	SDIUPQFRPYOBFY-MWQQHZPXSA-N

02Structuur en stereochemie

Two-dimensional chemical structure of Molnupiravir Impurity 19 — 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	CC(C)C(=O)OC[C@@H]1[C@H]([C@H]([C@@H](O1)N2C=CC(=NC2=O)NO)OC(=O)C(C)C)OC(=O)C(C)C
InChI	Niet vermeld

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.