Identità

Cytarabine Impurity 43

Non indicato · C9H11N3O4

01Identità

Lazychem ID	LC-45752
CAS RN	Non indicato
PubChem CID	11790863
Molecular formula	C9H11N3O4
Molecular weight	225.20 g/mol
IUPAC name	(2S,4R,5R,6R)-4-(hydroxymethyl)-10-imino-3,7-dioxa-1,9-diazatricyclo[6.4.0.02,6]dodeca-8,11-dien-5-ol
InChIKey	BBDAGFIXKZCXAH-JBBNEOJLSA-N

02Struttura e stereochimica

Two-dimensional chemical structure of Cytarabine Impurity 43 — 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 4 defined stereocentres. These statements are calculated from the published structure string.

Defined stereocentres	4
Ring count	3
Secondary amines	0
Tertiary amines	0

SMILES	C1=CN2[C@@H]3[C@@H]([C@@H]([C@H](O3)CO)O)OC2=NC1=N
InChI	Non indicato

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

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.