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

Details

Stereochemistry ABSOLUTE
Molecular Formula C19H21NO3
Molecular Weight 311.3749
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of (6AS)-5,6,6A,7-TETRAHYDRO-6-PROPYL-4H-DIBENZO(DE,G)QUINOLINE-2,10,11-TRIOL

SMILES

[H][C@@]12CC3=CC=C(O)C(O)=C3C4=CC(O)=CC(CCN1CCC)=C24

InChI

InChIKey=HLRBSTGXOFUEHW-HNNXBMFYSA-N
InChI=1S/C19H21NO3/c1-2-6-20-7-5-12-8-13(21)10-14-17(12)15(20)9-11-3-4-16(22)19(23)18(11)14/h3-4,8,10,15,21-23H,2,5-7,9H2,1H3/t15-/m0/s1

HIDE SMILES / InChI

Molecular Formula C19H21NO3
Molecular Weight 311.3749
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 Sat Dec 16 18:23:46 GMT 2023
Edited
by admin
on Sat Dec 16 18:23:46 GMT 2023
Record UNII
AU73JP9577
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
(6AS)-5,6,6A,7-TETRAHYDRO-6-PROPYL-4H-DIBENZO(DE,G)QUINOLINE-2,10,11-TRIOL
Systematic Name English
4H-DIBENZO(DE,G)QUINOLINE-2,10,11-TRIOL, 5,6,6A,7-TETRAHYDRO-6-PROPYL-, (6AS)-
Systematic Name English
Code System Code Type Description
CAS
1217598-17-8
Created by admin on Sat Dec 16 18:23:46 GMT 2023 , Edited by admin on Sat Dec 16 18:23:46 GMT 2023
PRIMARY
FDA UNII
AU73JP9577
Created by admin on Sat Dec 16 18:23:46 GMT 2023 , Edited by admin on Sat Dec 16 18:23:46 GMT 2023
PRIMARY
PUBCHEM
124303476
Created by admin on Sat Dec 16 18:23:46 GMT 2023 , Edited by admin on Sat Dec 16 18:23:46 GMT 2023
PRIMARY PUBCHEM