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

Details

Stereochemistry ACHIRAL
Molecular Formula C38H43N3O4S
Molecular Weight 637.831
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of FIBOFLAPON

SMILES

CCOC1=CC=C(C=N1)C2=CC=C(CN3C(CC(C)(C)C(O)=O)=C(SC(C)(C)C)C4=C3C=CC(OCC5=NC=C(C)C=C5)=C4)C=C2

InChI

InChIKey=DFQGDHBGRSTTHX-UHFFFAOYSA-N
InChI=1S/C38H43N3O4S/c1-8-44-34-18-14-28(22-40-34)27-12-10-26(11-13-27)23-41-32-17-16-30(45-24-29-15-9-25(2)21-39-29)19-31(32)35(46-37(3,4)5)33(41)20-38(6,7)36(42)43/h9-19,21-22H,8,20,23-24H2,1-7H3,(H,42,43)

HIDE SMILES / InChI

Molecular Formula C38H43N3O4S
Molecular Weight 637.831
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Fri Dec 15 19:39:57 UTC 2023
Edited
by admin
on Fri Dec 15 19:39:57 UTC 2023
Record UNII
Y1NA96IX3T
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
FIBOFLAPON
INN   USAN   WHO-DD  
INN   USAN  
Official Name English
AM803
Code English
FIBOFLAPON [USAN]
Common Name English
fiboflapon [INN]
Common Name English
Fiboflapon [WHO-DD]
Common Name English
GSK-2190915
Code English
3-(3-(TERT-BUTYLSULFANYL)-1-((4-(6-ETHOXYPYRIDIN-3-YL)PHENYL)METHYL)-5-((5-METHYLPYRIDIN-2-YL)METHOXY)-1H-INDOL-2-YL)-2,2-DIMETHYLPROPANOIC ACID
Systematic Name English
AM-803
Code English
1H-INDOLE-2-PROPANOIC ACID, 3-((1,1-DIMETHYLETHYL)THIO)-1-((4-(6-ETHOXY-3-PYRIDINYL)PHENYL)METHYL)-.ALPHA.,.ALPHA.-DIMETHYL-5-((5-METHYL-2-PYRIDINYL)METHOXY)-
Common Name English
GSK2190915
Code English
Code System Code Type Description
DRUG BANK
DB06346
Created by admin on Fri Dec 15 19:39:57 UTC 2023 , Edited by admin on Fri Dec 15 19:39:57 UTC 2023
PRIMARY
PUBCHEM
44473151
Created by admin on Fri Dec 15 19:39:57 UTC 2023 , Edited by admin on Fri Dec 15 19:39:57 UTC 2023
PRIMARY
ChEMBL
CHEMBL1922660
Created by admin on Fri Dec 15 19:39:57 UTC 2023 , Edited by admin on Fri Dec 15 19:39:57 UTC 2023
PRIMARY
SMS_ID
300000034241
Created by admin on Fri Dec 15 19:39:57 UTC 2023 , Edited by admin on Fri Dec 15 19:39:57 UTC 2023
PRIMARY
USAN
XX-128
Created by admin on Fri Dec 15 19:39:57 UTC 2023 , Edited by admin on Fri Dec 15 19:39:57 UTC 2023
PRIMARY
EPA CompTox
DTXSID20239496
Created by admin on Fri Dec 15 19:39:57 UTC 2023 , Edited by admin on Fri Dec 15 19:39:57 UTC 2023
PRIMARY
NCI_THESAURUS
C169978
Created by admin on Fri Dec 15 19:39:57 UTC 2023 , Edited by admin on Fri Dec 15 19:39:57 UTC 2023
PRIMARY
CAS
936350-00-4
Created by admin on Fri Dec 15 19:39:57 UTC 2023 , Edited by admin on Fri Dec 15 19:39:57 UTC 2023
PRIMARY
INN
9448
Created by admin on Fri Dec 15 19:39:57 UTC 2023 , Edited by admin on Fri Dec 15 19:39:57 UTC 2023
PRIMARY
FDA UNII
Y1NA96IX3T
Created by admin on Fri Dec 15 19:39:57 UTC 2023 , Edited by admin on Fri Dec 15 19:39:57 UTC 2023
PRIMARY
Related Record Type Details
TARGET -> INHIBITOR
SALT/SOLVATE -> PARENT
Related Record Type Details
ACTIVE MOIETY