Identidade

WIN-55212-2 mesylate

Não indicado · C28H30N2O6S

01Identidade

Lazychem ID	LC-83736
CAS RN	Não indicado
PubChem CID	6604176
Molecular formula	C28H30N2O6S
Molecular weight	522.6 g/mol
IUPAC name	methanesulfonic acid;[(11R)-2-methyl-11-(morpholin-4-ylmethyl)-9-oxa-1-azatricyclo[6.3.1.04,12]dodeca-2,4(12),5,7-tetraen-3-yl]-naphthalen-1-ylmethanone
InChIKey	FSGCSTPOPBJYSX-VEIFNGETSA-N

02Estrutura e estereoquímica

Two-dimensional chemical structure of WIN-55212-2 mesylate — Two-dimensional structure for the PubChem identity linked to this record. Confirm the identifiers before analytical use.

The parsed structure contains 6 rings, includes aromatic atoms, includes aliphatic carbon, has 1 defined stereocentre. These statements are calculated from the published structure string.

Defined stereocentres	1
Ring count	6
Secondary amines	0
Tertiary amines	1

SMILES	CC1=C(C2=C3N1[C@@H](COC3=CC=C2)CN4CCOCC4)C(=O)C5=CC=CC6=CC=CC=C65.CS(=O)(=O)O
InChI	Não indicado

03Stereochemistry

The published structure contains 1 defined and 0 unassigned tetrahedral stereocentre. The exact wedge and dash depiction is shown above.

Defined centres1Structure assigned

Unassigned centres0Structure unspecified

Assignment statusFully assignedExact published identity

Tetrahedral upper bound≤ 2Before 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.