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Details

Stereochemistry ABSOLUTE
Molecular Formula C16H22N4O3
Molecular Weight 318.3709
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of APAXIFYLLINE

SMILES

CCCN1C2=C(NC(=N2)[C@H]3CCC(=O)C3)C(=O)N(CCC)C1=O

InChI

InChIKey=RUHGOZFOVBMWOO-JTQLQIEISA-N
InChI=1S/C16H22N4O3/c1-3-7-19-14-12(15(22)20(8-4-2)16(19)23)17-13(18-14)10-5-6-11(21)9-10/h10H,3-9H2,1-2H3,(H,17,18)/t10-/m0/s1

HIDE SMILES / InChI

Molecular Formula C16H22N4O3
Molecular Weight 318.3709
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 Fri Dec 15 15:54:20 UTC 2023
Edited
by admin
on Fri Dec 15 15:54:20 UTC 2023
Record UNII
OG8HSX6N6H
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
APAXIFYLLINE
INN   USAN  
INN   USAN  
Official Name English
apaxifylline [INN]
Common Name English
BIIP20XX
Code English
(-)-(S)-8-(3-OXOCYCLOPENTYL)-1,3-DIPROPYLXANTHINE
Systematic Name English
APAXIFYLLINE [USAN]
Common Name English
BLIP-20-XX
Code English
BIIP-20XX
Code English
1H-PURINE-2,6-DIONE, 3,7-DIHYDRO-8-(3-OXOCYCLOPENTYL)-1,3-DIPROPYL-, (S)-
Common Name English
Classification Tree Code System Code
NCI_THESAURUS C1509
Created by admin on Fri Dec 15 15:54:20 UTC 2023 , Edited by admin on Fri Dec 15 15:54:20 UTC 2023
Code System Code Type Description
CAS
151581-23-6
Created by admin on Fri Dec 15 15:54:20 UTC 2023 , Edited by admin on Fri Dec 15 15:54:20 UTC 2023
PRIMARY
PUBCHEM
60949
Created by admin on Fri Dec 15 15:54:20 UTC 2023 , Edited by admin on Fri Dec 15 15:54:20 UTC 2023
PRIMARY
FDA UNII
OG8HSX6N6H
Created by admin on Fri Dec 15 15:54:20 UTC 2023 , Edited by admin on Fri Dec 15 15:54:20 UTC 2023
PRIMARY
EVMPD
SUB05536MIG
Created by admin on Fri Dec 15 15:54:20 UTC 2023 , Edited by admin on Fri Dec 15 15:54:20 UTC 2023
PRIMARY
SMS_ID
100000086976
Created by admin on Fri Dec 15 15:54:20 UTC 2023 , Edited by admin on Fri Dec 15 15:54:20 UTC 2023
PRIMARY
NCI_THESAURUS
C81046
Created by admin on Fri Dec 15 15:54:20 UTC 2023 , Edited by admin on Fri Dec 15 15:54:20 UTC 2023
PRIMARY
INN
7264
Created by admin on Fri Dec 15 15:54:20 UTC 2023 , Edited by admin on Fri Dec 15 15:54:20 UTC 2023
PRIMARY
USAN
GG-37
Created by admin on Fri Dec 15 15:54:20 UTC 2023 , Edited by admin on Fri Dec 15 15:54:20 UTC 2023
PRIMARY
ChEMBL
CHEMBL2104538
Created by admin on Fri Dec 15 15:54:20 UTC 2023 , Edited by admin on Fri Dec 15 15:54:20 UTC 2023
PRIMARY
Related Record Type Details
TARGET -> INHIBITOR
Related Record Type Details
ACTIVE MOIETY