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Details

Stereochemistry ABSOLUTE
Molecular Formula C22H33N3O4
Molecular Weight 403.5151
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of GSK-3117391

SMILES

ONC(=O)CCC1=NC=C(CN[C@@H](C2CCCCC2)C(=O)OC3CCCC3)C=C1

InChI

InChIKey=AFDPFLDWOXXHQM-NRFANRHFSA-N
InChI=1S/C22H33N3O4/c26-20(25-28)13-12-18-11-10-16(14-23-18)15-24-21(17-6-2-1-3-7-17)22(27)29-19-8-4-5-9-19/h10-11,14,17,19,21,24,28H,1-9,12-13,15H2,(H,25,26)/t21-/m0/s1

HIDE SMILES / InChI

Molecular Formula C22H33N3O4
Molecular Weight 403.5151
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Patents

Patents

Substance Class Chemical
Created
by admin
on Sat Dec 16 14:07:17 GMT 2023
Edited
by admin
on Sat Dec 16 14:07:17 GMT 2023
Record UNII
CKA3P0O1VI
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
GSK-3117391
Code English
CHR-5154
Code English
CHR5154
Code English
CHR 5154 [WHO-DD]
Common Name English
GSK3117391
Code English
HDAC-IN-3
Common Name English
CYCLOHEXANEACETIC ACID, .ALPHA.-(((6-(3-(HYDROXYAMINO)-3-OXOPROPYL)-3-PYRIDINYL)METHYL)AMINO)-, CYCLOPENTYL ESTER, (.ALPHA.S)-
Code English
Code System Code Type Description
FDA UNII
CKA3P0O1VI
Created by admin on Sat Dec 16 14:07:17 GMT 2023 , Edited by admin on Sat Dec 16 14:07:17 GMT 2023
PRIMARY
DRUG BANK
DB15440
Created by admin on Sat Dec 16 14:07:17 GMT 2023 , Edited by admin on Sat Dec 16 14:07:17 GMT 2023
PRIMARY
CAS
1018673-42-1
Created by admin on Sat Dec 16 14:07:17 GMT 2023 , Edited by admin on Sat Dec 16 14:07:17 GMT 2023
PRIMARY
PUBCHEM
53630042
Created by admin on Sat Dec 16 14:07:17 GMT 2023 , Edited by admin on Sat Dec 16 14:07:17 GMT 2023
PRIMARY
Related Record Type Details
ACTIVE MOIETY