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Details

Stereochemistry RACEMIC
Molecular Formula C17H23NO3
Molecular Weight 289.3694
Optical Activity ( + / - )
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 1,3,4,6,7,11B-HEXAHYDRO-9,10-DIHYDROXY-3-(2-METHYLPROPYL)-2H-BENZO(A)QUINOLIZIN-2-ONE, REL-(3R,11BR)-

SMILES

CC(C)C[C@H]1CN2CCC3=C(C=C(O)C(O)=C3)[C@@H]2CC1=O

InChI

InChIKey=HKXSWCIZVQFEQQ-JSGCOSHPSA-N
InChI=1S/C17H23NO3/c1-10(2)5-12-9-18-4-3-11-6-16(20)17(21)7-13(11)14(18)8-15(12)19/h6-7,10,12,14,20-21H,3-5,8-9H2,1-2H3/t12-,14-/m0/s1

HIDE SMILES / InChI

Approval Year

Unknown
149124
Name Type Language
1,3,4,6,7,11B-HEXAHYDRO-9,10-DIHYDROXY-3-(2-METHYLPROPYL)-2H-BENZO(A)QUINOLIZIN-2-ONE, REL-(3R,11BR)-
Systematic Name English
DTR-I
Preferred Name English
9,10-DIHYDROXY-3-ISOBUTYL-1,3,4,6,7,11B-HEXAHYDRO-2H-PYRIDO(2,1-A)ISOQUINOLIN-2-ONE
Systematic Name English
2H-BENZO(A)QUINOLIZIN-2-ONE, 1,3,4,6,7,11B-HEXAHYDRO-9,10-DIHYDROXY-3-ISOBUTYL-
Common Name English
2H-BENZO(A)QUINOLIZIN-2-ONE, 1,3,4,6,7,11B-HEXAHYDRO-9,10-DIHYDROXY-3-(2-METHYLPROPYL)-
Systematic Name English
1,3,4,6,7,11B-HEXAHYDRO-9,10-DIHYDROXY-3-(2-METHYLPROPYL)-2H-BENZO(A)QUINOLIZIN-2-ONE
Systematic Name English
Code System Code Type Description
PUBCHEM
59272831
Created by admin on Wed Apr 02 11:12:58 GMT 2025 , Edited by admin on Wed Apr 02 11:12:58 GMT 2025
PRIMARY
CAS
2220998-55-8
Created by admin on Wed Apr 02 11:12:58 GMT 2025 , Edited by admin on Wed Apr 02 11:12:58 GMT 2025
PRIMARY
FDA UNII
UN5LS7XT2Y
Created by admin on Wed Apr 02 11:12:58 GMT 2025 , Edited by admin on Wed Apr 02 11:12:58 GMT 2025
PRIMARY
NIH
NCATS
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