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Details

Stereochemistry RACEMIC
Molecular Formula C26H30N2O
Molecular Weight 386.5292
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of DR-4004

SMILES

O=C1NC2=C3C(CCCC13CCCCN4CCC(=CC4)C5=CC=CC=C5)=CC=C2

InChI

InChIKey=JBQOYPLKTTXLSQ-UHFFFAOYSA-N
InChI=1S/C26H30N2O/c29-25-26(16-7-11-22-10-6-12-23(27-25)24(22)26)15-4-5-17-28-18-13-21(14-19-28)20-8-2-1-3-9-20/h1-3,6,8-10,12-13H,4-5,7,11,14-19H2,(H,27,29)

HIDE SMILES / InChI

Molecular Formula C26H30N2O
Molecular Weight 386.5292
Charge 0
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 08:01:46 GMT 2023
Edited
by admin
on Sat Dec 16 08:01:46 GMT 2023
Record UNII
27CN8PNO4K
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
DR-4004
Common Name English
BENZ(CD)INDOL-2(1H)-ONE, 2A-(4-(3,6-DIHYDRO-4-PHENYL-1(2H)-PYRIDINYL)BUTYL)-2A,3,4,5-TETRAHYDRO-
Systematic Name English
DR-4004, (±)-
Code English
Code System Code Type Description
CAS
201608-41-5
Created by admin on Sat Dec 16 08:01:46 GMT 2023 , Edited by admin on Sat Dec 16 08:01:46 GMT 2023
PRIMARY
FDA UNII
27CN8PNO4K
Created by admin on Sat Dec 16 08:01:46 GMT 2023 , Edited by admin on Sat Dec 16 08:01:46 GMT 2023
PRIMARY
PUBCHEM
9843179
Created by admin on Sat Dec 16 08:01:46 GMT 2023 , Edited by admin on Sat Dec 16 08:01:46 GMT 2023
PRIMARY
Related Record Type Details
ACTIVE MOIETY