Tożsamość

Posaconazole Impurity 326

Nie podano · C44H48F2N8O4

01Tożsamość

Lazychem ID	LC-37005
CAS RN	Nie podano
PubChem CID	89463936
Molecular formula	C44H48F2N8O4
Molecular weight	790.9 g/mol
IUPAC name	4-[4-[4-[4-[[(3R,5R)-5-(2,4-difluorophenyl)-5-(1,2,4-triazol-1-ylmethyl)oxolan-3-yl]methoxy]phenyl]piperazin-1-yl]phenyl]-2-[(2S,3R)-2-phenylmethoxypentan-3-yl]-1,2,4-triazol-3-one
InChIKey	XZBSQKGAKKWACB-MLXWFCCRSA-N

02Struktura i stereochemia

Two-dimensional chemical structure of Posaconazole Impurity 326 — Two-dimensional structure for the PubChem identity linked to this record. Confirm the identifiers before analytical use.

SMILES	CC[C@H]([C@H](C)OCC1=CC=CC=C1)N2C(=O)N(C=N2)C3=CC=C(C=C3)N4CCN(CC4)C5=CC=C(C=C5)OC[C@H]6C[C@](OC6)(CN7C=NC=N7)C8=C(C=C(C=C8)F)F
InChI	Nie podano

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.