Identitet

Hyoscyamine Impurity 9

Ikke angivet · C17H23NO4

01Identitet

Lazychem IDLC-50124
CAS RNIkke angivet
PubChem CID1403492
Molecular formulaC17H23NO4
Molecular weight305.4 g/mol
IUPAC name[(1R,3S,5R,6S)-6-hydroxy-8-methyl-8-azabicyclo[3.2.1]octan-3-yl] (2R)-3-hydroxy-2-phenylpropanoate
InChIKeyWTQYWNWRJNXDEG-GVRJEKJASA-N

02Struktur og stereokemi

2D structurePubChem CID 1403492
Two-dimensional chemical structure of Hyoscyamine Impurity 9
Two-dimensional structure for the PubChem identity linked to this record. Confirm the identifiers before analytical use.

The parsed structure contains 3 rings, includes aromatic atoms, includes aliphatic carbon, has 5 defined stereocentres. These statements are calculated from the published structure string.

Defined stereocentres5
Ring count3
Secondary amines0
Tertiary amines1
SMILESCN1[C@H]2C[C@@H](C[C@@H]1[C@H](C2)O)OC(=O)[C@@H](CO)C3=CC=CC=C3
InChIIkke angivet

03Stereochemistry

The published structure contains 5 defined and 0 unassigned tetrahedral stereocentres. The exact wedge and dash depiction is shown above.

Defined centres5Structure assigned
Unassigned centres0Structure unspecified
Assignment statusFully assignedExact published identity
Tetrahedral upper bound≤ 32Before symmetry reduction

Published same-connectivity configurations

6 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.

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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