Identiteit

Adenosine Impurity 54

Niet vermeld · C14H18N5O7P

01Identiteit

Lazychem ID	LC-49196
CAS RN	Niet vermeld
PubChem CID	5163192
Molecular formula	C14H18N5O7P
Molecular weight	399.30 g/mol
IUPAC name	N-[9-(2,7-dihydroxy-2-oxo-4a,6,7,7a-tetrahydro-4H-furo[3,2-d][1,3,2]dioxaphosphinin-6-yl)purin-6-yl]butanamide
InChIKey	NVGDLMUKSMHEQT-UHFFFAOYSA-N

02Structuur en stereochemie

Two-dimensional chemical structure of Adenosine Impurity 54 — Two-dimensional structure for the PubChem identity linked to this record. Confirm the identifiers before analytical use.

The parsed structure contains 4 rings, includes aromatic atoms, includes aliphatic carbon. These statements are calculated from the published structure string.

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

SMILES	CCCC(=O)NC1=C2C(=NC=N1)N(C=N2)C3C(C4C(O3)COP(=O)(O4)O)O
InChI	Niet vermeld

03Stereochemistry

The published structure contains 0 defined and 5 unassigned tetrahedral stereocentres. The exact wedge and dash depiction is shown above.

Defined centres0Structure assigned

Unassigned centres5Structure unspecified

Assignment statusUnassignedExact published identity

Tetrahedral upper bound≤ 32Before 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.