Identita

Alendronic Acid Impurity 2

Neuvedeno · C4H11NO8P3+

01Identita

Lazychem ID	LC-32626
CAS RN	Neuvedeno
PubChem CID	176485423
Molecular formula	C4H11NO8P3+
Molecular weight	294.05 g/mol
IUPAC name	5-(3-aminopropyl)-4,6-dihydroxy-2,4,6-trioxo-1,3,2,4lambda5,6lambda5-dioxatriphosphinan-2-ium-5-ol
InChIKey	DWSCGKIRXXTXDQ-UHFFFAOYSA-O

02Struktura a stereochemie

Two-dimensional chemical structure of Alendronic Acid Impurity 2 — Two-dimensional structure for the PubChem identity linked to this record. Confirm the identifiers before analytical use.

The parsed structure contains 1 ring, includes aliphatic carbon. These statements are calculated from the published structure string.

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

SMILES	C(CC1(P(=O)(O[P+](=O)OP1(=O)O)O)O)CN
InChI	Neuvedeno

03Stereochemistry

The published structure contains 0 defined and 2 unassigned tetrahedral stereocentres. The exact wedge and dash depiction is shown above.

Defined centres0Structure assigned

Unassigned centres2Structure unspecified

Assignment statusUnassignedExact 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.