Identita

Dutasteride EP Impurity H

Neuvedené · C46H55F6N3O4

01Identita

Lazychem IDLC-31724
CAS RNNeuvedené
PubChem CID162368457
Molecular formulaC46H55F6N3O4
Molecular weight827.94 g/mol
IUPAC nameN-[2, 5-Bis(Trifluoromethyl)phenyl]-3-oxo-4-[3-oxo-4-aza-5α-androst-1-ene-17α-carbonyl]-4-aza-5α-androst-1-ene-17β-carboxamide
InChIKeyVHEQRKYIOQGSHW-XLWBPLANSA-N

02Štruktúra a stereochémia

2D structurePubChem CID 162368457
Two-dimensional chemical structure of Dutasteride EP Impurity H
Two-dimensional structure for the PubChem identity linked to this record. Confirm the identifiers before analytical use.

The parsed structure contains 9 rings, includes aromatic atoms, includes aliphatic carbon, has 14 defined stereocentres, contains at least one halogen atom. These statements are calculated from the published structure string.

Defined stereocentres14
Ring count9
Secondary amines0
Tertiary amines0
SMILESC[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@@H]2C(=O)NC4=C(C=CC(=C4)C(F)(F)F)C(F)(F)F)CC[C@@H]5[C@@]3(C=CC(=O)N5C(=O)[C@@H]6CC[C@@H]7[C@@]6(CC[C@H]8[C@H]7CC[C@@H]9[C@@]8(C=CC(=O)N9)C)C)C
InChINeuvedené

03Stereochemistry

The published structure contains 14 defined and 0 unassigned tetrahedral stereocentres. The exact wedge and dash depiction is shown above.

Defined centres14Structure assigned
Unassigned centres0Structure unspecified
Assignment statusFully assignedExact published identity
Tetrahedral upper bound≤ 16,384Before 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.

Scope: The mathematical 2^n value is only an upper bound. Symmetry and other stereogenic elements can change the number of distinct stereoisomers. A hypothetical configuration is not published as a compound record without a verified structure identity.

04Stav v Indii

Exact-compound status is evaluated only against the published name and CAS number. Confirm the current official instrument before a regulatory decision.

05Názvy a vzťahy

API a materské liečivo

Dutasteride

Nečistoty a súvisiace zlúčeniny

Názvy a vzťahy

  • Dutasteride Dimer 1
  • Dutasteride α-dimer

Nečistoty a súvisiace zlúčeniny

06Zdroje