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

Details

Stereochemistry ABSOLUTE
Molecular Formula C19H27N3O3
Molecular Weight 345.436
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of AMB

SMILES

CCCCCN1N=C(C(=O)N[C@@H](C(C)C)C(=O)OC)C2=CC=CC=C12

InChI

InChIKey=KTTMFFHXDMTTOB-INIZCTEOSA-N
InChI=1S/C19H27N3O3/c1-5-6-9-12-22-15-11-8-7-10-14(15)17(21-22)18(23)20-16(13(2)3)19(24)25-4/h7-8,10-11,13,16H,5-6,9,12H2,1-4H3,(H,20,23)/t16-/m0/s1

HIDE SMILES / InChI

Molecular Formula C19H27N3O3
Molecular Weight 345.436
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 Sat Dec 16 10:40:45 GMT 2023
Edited
by admin
on Sat Dec 16 10:40:45 GMT 2023
Record UNII
0ETP8M4H3E
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
AMB
Common Name English
L-VALINE, N-((1-PENTYL-1H-INDAZOL-3-YL)CARBONYL)-, METHYL ESTER
Systematic Name English
METHYL (1-PENTYL-1H-INDAZOLE-3-CARBONYL)-L-VALINATE
Systematic Name English
Classification Tree Code System Code
WIKIPEDIA Designer-drugs-METHYL (1-PENTYL-1H-INDAZOLE-3-CARBONYL)-L-VALINATE
Created by admin on Sat Dec 16 10:40:45 GMT 2023 , Edited by admin on Sat Dec 16 10:40:45 GMT 2023
Code System Code Type Description
FDA UNII
0ETP8M4H3E
Created by admin on Sat Dec 16 10:40:45 GMT 2023 , Edited by admin on Sat Dec 16 10:40:45 GMT 2023
PRIMARY
PUBCHEM
119025725
Created by admin on Sat Dec 16 10:40:45 GMT 2023 , Edited by admin on Sat Dec 16 10:40:45 GMT 2023
PRIMARY
CAS
1890250-13-1
Created by admin on Sat Dec 16 10:40:45 GMT 2023 , Edited by admin on Sat Dec 16 10:40:45 GMT 2023
PRIMARY
Related Record Type Details
TARGET -> AGONIST
Ki
RACEMATE -> ENANTIOMER
TARGET -> AGONIST
Ki
Related Record Type Details
ACTIVE MOIETY