Identiteta

Vespertilin acetate

Ni navedeno · C24H34O4

01Identiteta

Lazychem ID	LC-46428
CAS RN	Ni navedeno
PubChem CID	11153402
Molecular formula	C24H34O4
Molecular weight	386.5 g/mol
IUPAC name	[(1S,2S,4S,7S,8R,9S,12S,13R,16S)-7,9,13-trimethyl-6-oxo-5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icos-18-en-16-yl] acetate
InChIKey	OWDSQNAIMXYQHD-TXWMIOKHSA-N

02Struktura in stereokemija

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

The parsed structure contains 5 rings, includes aliphatic carbon, has 9 defined stereocentres. These statements are calculated from the published structure string.

Defined stereocentres	9
Ring count	5
Secondary amines	0
Tertiary amines	0

SMILES	C[C@H]1[C@H]2[C@H](C[C@@H]3[C@@]2(CC[C@H]4[C@H]3CC=C5[C@@]4(CC[C@@H](C5)OC(=O)C)C)C)OC1=O
InChI	Ni navedeno

03Stereochemistry

The published structure contains 9 defined and 0 unassigned tetrahedral stereocentres. The exact wedge and dash depiction is shown above.

Defined centres9Structure assigned

Unassigned centres0Structure unspecified

Assignment statusFully assignedExact published identity

Tetrahedral upper bound≤ 512Before 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.