Identität

(-)-3-Methoxy Butorphanol

Nicht angegeben · C22H31NO2

01Identität

Lazychem ID	LC-44888
CAS RN	Nicht angegeben
PubChem CID	13080261
Molecular formula	C22H31NO2
Molecular weight	341.5 g/mol
IUPAC name	(1S,9R,10S)-17-(cyclobutylmethyl)-4-methoxy-17-azatetracyclo[7.5.3.01,10.02,7]heptadeca-2(7),3,5-trien-10-ol
InChIKey	DTVODKGBEXBXFW-BHIFYINESA-N

02Struktur und Stereochemie

Two-dimensional chemical structure of (-)-3-Methoxy Butorphanol — Two-dimensional structure for the PubChem identity linked to this record. Confirm the identifiers before analytical use.

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

Defined stereocentres	3
Ring count	5
Secondary amines	0
Tertiary amines	1

SMILES	COC1=CC2=C(C[C@@H]3[C@]4([C@@]2(CCCC4)CCN3CC5CCC5)O)C=C1
InChI	Nicht angegeben

03Stereochemistry

The published structure contains 3 defined and 0 unassigned tetrahedral stereocentres. The exact wedge and dash depiction is shown above.

Defined centres3Structure assigned

Unassigned centres0Structure unspecified

Assignment statusFully assignedExact published identity

Tetrahedral upper bound≤ 8Before 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.