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Details

Stereochemistry RACEMIC
Molecular Formula C19H24N2O3
Molecular Weight 328.4055
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 4-HYDROXYCYCLOHEXYLCARBOXYLATE

SMILES

OC1CCC(CC1)C(=O)N2CC3N(CCC4=CC=CC=C34)C(=O)C2

InChI

InChIKey=OKTGUGBZQBTMHZ-UHFFFAOYSA-N
InChI=1S/C19H24N2O3/c22-15-7-5-14(6-8-15)19(24)20-11-17-16-4-2-1-3-13(16)9-10-21(17)18(23)12-20/h1-4,14-15,17,22H,5-12H2

HIDE SMILES / InChI

Molecular Formula C19H24N2O3
Molecular Weight 328.4055
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 19:03:48 UTC 2023
Edited
by admin
on Sat Dec 16 19:03:48 UTC 2023
Record UNII
S76ZX3N3LF
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
4-HYDROXYCYCLOHEXYLCARBOXYLATE
Common Name English
4H-PYRAZINO(2,1-A)ISOQUINOLIN-4-ONE, 1,2,3,6,7,11B-HEXAHYDRO-2-((4-HYDROXYCYCLOHEXYL)CARBONYL)-
Systematic Name English
1,2,3,6,7,11B-HEXAHYDRO-2-((4-HYDROXYCYCLOHEXYL)CARBONYL)-4H-PYRAZINO(2,1-A)ISOQUINOLIN-4-ONE
Systematic Name English
Code System Code Type Description
PUBCHEM
173759
Created by admin on Sat Dec 16 19:03:49 UTC 2023 , Edited by admin on Sat Dec 16 19:03:49 UTC 2023
PRIMARY
FDA UNII
S76ZX3N3LF
Created by admin on Sat Dec 16 19:03:49 UTC 2023 , Edited by admin on Sat Dec 16 19:03:49 UTC 2023
PRIMARY
CAS
60743-58-0
Created by admin on Sat Dec 16 19:03:49 UTC 2023 , Edited by admin on Sat Dec 16 19:03:49 UTC 2023
PRIMARY
Related Record Type Details
PARENT -> METABOLITE
Metabolite also catalyzed by CYP3A4.
PLASMA; URINE