U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ABSOLUTE
Molecular Formula C15H21N3O
Molecular Weight 259.3467
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of QUINOCIDE, (S)-

SMILES

COC1=CC2=C(N=CC=C2)C(NCCC[C@H](C)N)=C1

InChI

InChIKey=NBAFIBBHADOTMU-NSHDSACASA-N
InChI=1S/C15H21N3O/c1-11(16)5-3-7-17-14-10-13(19-2)9-12-6-4-8-18-15(12)14/h4,6,8-11,17H,3,5,7,16H2,1-2H3/t11-/m0/s1

HIDE SMILES / InChI

Molecular Formula C15H21N3O
Molecular Weight 259.3467
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Mon Mar 31 23:44:20 GMT 2025
Edited
by admin
on Mon Mar 31 23:44:20 GMT 2025
Record UNII
Y5Y306TH2M
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
QUINOCIDE, (S)-
Common Name English
QUINOCIDE, (+)-
Preferred Name English
1,4-PENTANEDIAMINE, N1-(6-METHOXY-8-QUINOLINYL)-, (S)-
Systematic Name English
Code System Code Type Description
FDA UNII
Y5Y306TH2M
Created by admin on Mon Mar 31 23:44:20 GMT 2025 , Edited by admin on Mon Mar 31 23:44:20 GMT 2025
PRIMARY
CAS
738578-54-6
Created by admin on Mon Mar 31 23:44:20 GMT 2025 , Edited by admin on Mon Mar 31 23:44:20 GMT 2025
PRIMARY
PUBCHEM
1596257
Created by admin on Mon Mar 31 23:44:20 GMT 2025 , Edited by admin on Mon Mar 31 23:44:20 GMT 2025
PRIMARY
Related Record Type Details
RACEMATE -> ENANTIOMER