Identita

Dihydroelymoclavine

Neuvedeno · C16H20N2O

01Identita

Lazychem ID	LC-49166
CAS RN	Neuvedeno
PubChem CID	5274124
Molecular formula	C16H20N2O
Molecular weight	256.34 g/mol
IUPAC name	[(6aR,9R,10aR)-7-methyl-6,6a,8,9,10,10a-hexahydro-4H-indolo[4,3-fg]quinolin-9-yl]methanol
InChIKey	UFKTZIXVYHGAES-WDBKCZKBSA-N

02Struktura a stereochemie

Two-dimensional chemical structure of Dihydroelymoclavine — 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 3 defined stereocentres. These statements are calculated from the published structure string.

Defined stereocentres	3
Ring count	4
Secondary amines	0
Tertiary amines	1

SMILES	CN1C[C@@H](C[C@H]2[C@H]1CC3=CNC4=CC=CC2=C34)CO
InChI	Neuvedeno

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.