Identidad

Bromocriptine EP Impurity D

CAS 478-83-1 · C16H15BrN2O2

01Identidad

Lazychem IDLC-08819
CAS RN478-83-1
PubChem CID12300190
Molecular formulaC16H15BrN2O2
Molecular weight347.21 g/mol
IUPAC name(6aR,9R)-5-bromo-7-methyl-4,6,6a,7,8,9-hexahydroindolo[4,3-fg]quinoline-9-carboxylic acid
InChIKeyIPSOSLBLNUSDJQ-AMIZOPFISA-N

02Estructura y estereoquímica

2D structurePubChem CID 12300190
Two-dimensional chemical structure of Bromocriptine EP Impurity D, CAS 478-83-1
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, has 2 defined stereocentres, contains at least one halogen atom. These statements are calculated from the published structure string.

Defined stereocentres2
Ring count4
Secondary amines0
Tertiary amines1
SMILESCN1C[C@@H](C=C2[C@H]1CC3=C(NC4=CC=CC2=C34)Br)C(=O)O
InChINo indicado

03Stereochemistry

The published structure contains 2 defined and 0 unassigned tetrahedral stereocentres. The exact wedge and dash depiction is shown above.

Defined centres2Structure assigned
Unassigned centres0Structure unspecified
Assignment statusFully assignedExact published identity
Tetrahedral upper bound≤ 4Before 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.

04Estado en India

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

05Nombres y relaciones

API y fármaco de origen

Bromocriptine

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Nombres y relaciones

  • 2-Bromolysergic Acid

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06Fuentes