Tunnistetiedot

Beraprost Impurity 43

Ei ilmoitettu · C19H24O5

01Tunnistetiedot

Lazychem ID	LC-47580
CAS RN	Ei ilmoitettu
PubChem CID	10131655
Molecular formula	C19H24O5
Molecular weight	332.4 g/mol
IUPAC name	methyl 4-[(1S,2S,7R,9S)-5-methyl-4,6,10-trioxatetracyclo[7.7.0.02,7.011,16]hexadeca-11,13,15-trien-12-yl]butanoate
InChIKey	MLDFAVICQXJJFG-FYYGBJPPSA-N

02Rakenne ja stereokemia

Two-dimensional chemical structure of Beraprost Impurity 43 — Two-dimensional structure for the PubChem identity linked to this record. Confirm the identifiers before analytical use.

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

Defined stereocentres	4
Ring count	4
Secondary amines	0
Tertiary amines	0

SMILES	CC1OC[C@H]2[C@H](O1)C[C@H]3[C@@H]2C4=CC=CC(=C4O3)CCCC(=O)OC
InChI	Ei ilmoitettu

03Stereochemistry

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

Defined centres4Structure assigned

Unassigned centres1Structure unspecified

Assignment statusPartially assignedExact published identity

Tetrahedral upper bound≤ 32Before 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.