Identidad

Emodepside Impurity 5

No indicado · C64H84N4O12

01Identidad

Lazychem ID	LC-36500
CAS RN	No indicado
PubChem CID	101062241
Molecular formula	C64H84N4O12
Molecular weight	1101.4 g/mol
IUPAC name	(3S,6R,9S,12R,15S,18R,21S,24R)-6,12,18,24-tetrabenzyl-4,10,16,22-tetramethyl-3,9,15,21-tetrakis(2-methylpropyl)-1,7,13,19-tetraoxa-4,10,16,22-tetrazacyclotetracosane-2,5,8,11,14,17,20,23-octone
InChIKey	ILQZHPWFOWCYND-SQZSLCRCSA-N

02Estructura y estereoquímica

Two-dimensional chemical structure of Emodepside Impurity 5 — Two-dimensional structure for the PubChem identity linked to this record. Confirm the identifiers before analytical use.

The parsed structure contains 5 rings, includes aromatic atoms, includes aliphatic carbon, has 8 defined stereocentres. These statements are calculated from the published structure string.

Defined stereocentres	8
Ring count	5
Secondary amines	0
Tertiary amines	0

SMILES	CC(C)C[C@H]1C(=O)O[C@@H](C(=O)N([C@H](C(=O)O[C@@H](C(=O)N([C@H](C(=O)O[C@@H](C(=O)N([C@H](C(=O)O[C@@H](C(=O)N1C)CC2=CC=CC=C2)CC(C)C)C)CC3=CC=CC=C3)CC(C)C)C)CC4=CC=CC=C4)CC(C)C)C)CC5=CC=CC=C5
InChI	No indicado

03Stereochemistry

The published structure contains 8 defined and 0 unassigned tetrahedral stereocentres. The exact wedge and dash depiction is shown above.

Defined centres8Structure assigned

Unassigned centres0Structure unspecified

Assignment statusFully assignedExact published identity

Tetrahedral upper bound≤ 256Before 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.