Identität

Rocuronium Allyl Derivative Impurity

Nicht angegeben · C35H57BrN2O4

01Identität

Lazychem IDLC-32424
CAS RNNicht angegeben
PubChem CID169445884
Molecular formulaC35H57BrN2O4
Molecular weight649.74 g/mol
IUPAC name1-((2S,3S,5S,8R,9S,10S,13S,14S,16S,17R)-17-acetoxy-3-(allyloxy)-10,13-dimethyl-2-morpholinohexadecahydro-1H-cyclopenta[a]phenanthren-16-yl)-1-allylpyrrolidin-1-ium bromide
InChIKeyHVEYPOULHRVLJJ-MHLFSCIFSA-M

02Struktur und Stereochemie

2D structurePubChem CID 169445884
Two-dimensional chemical structure of Rocuronium Allyl Derivative Impurity
Two-dimensional structure for the PubChem identity linked to this record. Confirm the identifiers before analytical use.
SMILESCC(=O)O[C@H]1[C@H](C[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC[C@@H]4[C@@]3(C[C@@H]([C@H](C4)OCC=C)N5CCOCC5)C)C)[N+]6(CCCC6)CC=C.[Br-]
InChINicht angegeben

03Stereochemistry

The published structure contains 10 defined and 0 unassigned tetrahedral stereocentres. The exact wedge and dash depiction is shown above.

Defined centres10Structure assigned
Unassigned centres0Structure unspecified
Assignment statusFully assignedExact published identity
Tetrahedral upper bound≤ 1,024Before 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.

No additional structure-linked configuration with the same connectivity is currently present in the LazyChem dataset.

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.

04Status in Indien

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

05Namen und Beziehungen

API und Ausgangsarzneistoff

Rocuronium Bromide

Verunreinigungen und verwandte Verbindungen

Namen und Beziehungen

  • 3-O-Allyl Rocuronium Bromide

Verunreinigungen und verwandte Verbindungen

06Quellen