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Details

Stereochemistry ABSOLUTE
Molecular Formula C13H16N2O
Molecular Weight 216.2789
Optical Activity UNSPECIFIED
Defined Stereocenters 3 / 3
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of DIANICLINE

SMILES

[H][C@]12CC[N@@]3CC[C@]1(C3)CC4=C(O2)C=CC=N4

InChI

InChIKey=SUPRUPHAEXPGPF-QWHCGFSZSA-N
InChI=1S/C13H16N2O/c1-2-11-10(14-5-1)8-13-4-7-15(9-13)6-3-12(13)16-11/h1-2,5,12H,3-4,6-9H2/t12-,13+/m0/s1

HIDE SMILES / InChI
Molecular Formula C13H16N2O
Molecular Weight 216.2789
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 2 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Unknown
86413
Substance Class Chemical
Created
by admin
on Sat Dec 16 16:04:26 UTC 2023
Edited
by admin
on Sat Dec 16 16:04:26 UTC 2023
Record UNII
Y0SNM34C6O
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
DIANICLINE
INN  
INN  
Official Name English
(5AS,10AR)-6,7,9,10-TETRAHYDRO-5AH,11H-8,10A-METHANOPYRIDO(2',3':5,6)PYRANO(2,3-D)AZEPINE
Common Name English
SSR-591813
Code English
dianicline [INN]
Common Name English
SSR591813
Code English
Classification Tree Code System Code
NCI_THESAURUS C73579
Created by admin on Sat Dec 16 16:04:26 UTC 2023 , Edited by admin on Sat Dec 16 16:04:26 UTC 2023
Code System Code Type Description
CAS
292634-27-6
Created by admin on Sat Dec 16 16:04:26 UTC 2023 , Edited by admin on Sat Dec 16 16:04:26 UTC 2023
PRIMARY
PUBCHEM
10176764
Created by admin on Sat Dec 16 16:04:26 UTC 2023 , Edited by admin on Sat Dec 16 16:04:26 UTC 2023
PRIMARY
MESH
C475773
Created by admin on Sat Dec 16 16:04:26 UTC 2023 , Edited by admin on Sat Dec 16 16:04:26 UTC 2023
PRIMARY
ChEMBL
CHEMBL187927
Created by admin on Sat Dec 16 16:04:26 UTC 2023 , Edited by admin on Sat Dec 16 16:04:26 UTC 2023
PRIMARY
NCI_THESAURUS
C76073
Created by admin on Sat Dec 16 16:04:26 UTC 2023 , Edited by admin on Sat Dec 16 16:04:26 UTC 2023
PRIMARY
INN
8639
Created by admin on Sat Dec 16 16:04:26 UTC 2023 , Edited by admin on Sat Dec 16 16:04:26 UTC 2023
PRIMARY
SMS_ID
100000174915
Created by admin on Sat Dec 16 16:04:26 UTC 2023 , Edited by admin on Sat Dec 16 16:04:26 UTC 2023
PRIMARY
WIKIPEDIA
DIANICLINE
Created by admin on Sat Dec 16 16:04:26 UTC 2023 , Edited by admin on Sat Dec 16 16:04:26 UTC 2023
PRIMARY
DRUG BANK
DB12125
Created by admin on Sat Dec 16 16:04:26 UTC 2023 , Edited by admin on Sat Dec 16 16:04:26 UTC 2023
PRIMARY
FDA UNII
Y0SNM34C6O
Created by admin on Sat Dec 16 16:04:26 UTC 2023 , Edited by admin on Sat Dec 16 16:04:26 UTC 2023
PRIMARY
EPA CompTox
DTXSID30870314
Created by admin on Sat Dec 16 16:04:26 UTC 2023 , Edited by admin on Sat Dec 16 16:04:26 UTC 2023
PRIMARY
Related Record Type Details
α4β2 Nicotinic acetylcholine receptor
TARGET->PARTIAL AGONIST
Related Record Type Details
Structure of DIANICLINE
ACTIVE MOIETY
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