Identitet

Relebactam Impurity 102

Ikke angivet · C14H22N4O6S

01Identitet

Lazychem IDLC-35674
CAS RNIkke angivet
PubChem CID126709450
Molecular formulaC14H22N4O6S
Molecular weight374.42 g/mol
IUPAC name[(2S,5R)-2-(3-azabicyclo[3.2.1]octan-8-ylcarbamoyl)-7-oxo-1,6-diazabicyclo[3.2.1]octan-6-yl] hydrogen sulfate
InChIKeyGGFHJVFMYZFKTD-BMRWJMQYSA-N

02Struktur og stereokemi

2D structurePubChem CID 126709450
Two-dimensional chemical structure of Relebactam Impurity 102
Two-dimensional structure for the PubChem identity linked to this record. Confirm the identifiers before analytical use.

The parsed structure contains 4 rings, includes aliphatic carbon, has 2 defined stereocentres. These statements are calculated from the published structure string.

Defined stereocentres2
Ring count4
Secondary amines1
Tertiary amines0
SMILESC1C[C@H](N2C[C@@H]1N(C2=O)OS(=O)(=O)O)C(=O)NC3C4CCC3CNC4
InChIIkke angivet

03Stereochemistry

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

Defined centres2Structure assigned
Unassigned centres2Structure unspecified
Assignment statusPartially assignedExact published identity
Tetrahedral upper bound≤ 16Before 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 i Indien

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

05Navne og relationer

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