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Bimatoprost Impurity 4

Ei ilmoitettu · C25H37NO4

01Tunnistetiedot

Lazychem IDLC-40712
CAS RNEi ilmoitettu
PubChem CID52194208
Molecular formulaC25H37NO4
Molecular weight415.6 g/mol
IUPAC name(Z)-7-[(1S,2R,3S,5R)-3,5-dihydroxy-2-[(E,3R)-3-hydroxy-5-phenylpent-1-enyl]cyclopentyl]-N-ethylhept-5-enamide
InChIKeyAQOKCDNYWBIDND-LCFQFDKJSA-N

02Rakenne ja stereokemia

2D structurePubChem CID 52194208
Two-dimensional chemical structure of Bimatoprost Impurity 4
Two-dimensional structure for the PubChem identity linked to this record. Confirm the identifiers before analytical use.

The parsed structure contains 2 rings, includes aromatic atoms, includes aliphatic carbon, has 5 defined stereocentres. These statements are calculated from the published structure string.

Defined stereocentres5
Ring count2
Secondary amines0
Tertiary amines0
SMILESCCNC(=O)CCC/C=C\C[C@@H]1[C@@H](C[C@@H]([C@@H]1/C=C/[C@@H](CCC2=CC=CC=C2)O)O)O
InChIEi ilmoitettu

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

4 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.

04Tila Intiassa

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

05Nimet ja suhteet

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    Epäpuhtaudet ja lähiyhdisteet

      06Lähteet