Identidade

6-beta-Hydroxyhyoscyamine

Não indicado · C17H23NO4

01Identidade

Lazychem IDLC-35395
CAS RNNão indicado
PubChem CID129628892
Molecular formulaC17H23NO4
Molecular weight305.4 g/mol
IUPAC name(6-hydroxy-8-methyl-8-azabicyclo[3.2.1]octan-3-yl) (2S)-3-hydroxy-2-phenylpropanoate
InChIKeyWTQYWNWRJNXDEG-GMOYYMRRSA-N

02Estrutura e estereoquímica

2D structurePubChem CID 129628892
Two-dimensional chemical structure of 6-beta-Hydroxyhyoscyamine
Two-dimensional structure for the PubChem identity linked to this record. Confirm the identifiers before analytical use.
SMILESCN1C2CC(CC1C(C2)O)OC(=O)[C@H](CO)C3=CC=CC=C3
InChINão indicado

03Stereochemistry

The published structure contains 1 defined and 4 unassigned tetrahedral stereocentres. The exact wedge and dash depiction is shown above.

Defined centres1Structure assigned
Unassigned centres4Structure unspecified
Assignment statusPartially 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.

04Estado na Índia

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

05Nomes e relações

API e fármaco de origem

Não indicado

Nomes e relações

    Impurezas e compostos relacionados

      06Fontes