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Details

Stereochemistry ABSOLUTE
Molecular Formula C18H26ClN3O5
Molecular Weight 399.869
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ATI-7400

SMILES

CO[C@H]1CN(CCCC(O)=O)CC[C@H]1NC(=O)C2=C(OC)C=C(N)C(Cl)=C2

InChI

InChIKey=YJSHQGHIZXDNHW-ZBFHGGJFSA-N
InChI=1S/C18H26ClN3O5/c1-26-15-9-13(20)12(19)8-11(15)18(25)21-14-5-7-22(10-16(14)27-2)6-3-4-17(23)24/h8-9,14,16H,3-7,10,20H2,1-2H3,(H,21,25)(H,23,24)/t14-,16+/m1/s1

HIDE SMILES / InChI

Molecular Formula C18H26ClN3O5
Molecular Weight 399.869
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 2 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Thu Jul 06 21:13:42 UTC 2023
Edited
by admin
on Thu Jul 06 21:13:42 UTC 2023
Record UNII
PCZ4T836HV
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
ATI-7400
Common Name English
NARONAPRIDE METABOLITE M1
Common Name English
1-PIPERIDINEBUTANOIC ACID, 4-((4-AMINO-5-CHLORO-2-METHOXYBENZOYL)AMINO)-3-METHOXY-, (3S,4R)-
Systematic Name English
Code System Code Type Description
PUBCHEM
15231278
Created by admin on Thu Jul 06 21:13:42 UTC 2023 , Edited by admin on Thu Jul 06 21:13:42 UTC 2023
PRIMARY
CAS
1346751-90-3
Created by admin on Thu Jul 06 21:13:42 UTC 2023 , Edited by admin on Thu Jul 06 21:13:42 UTC 2023
PRIMARY
FDA UNII
PCZ4T836HV
Created by admin on Thu Jul 06 21:13:42 UTC 2023 , Edited by admin on Thu Jul 06 21:13:42 UTC 2023
PRIMARY
Related Record Type Details
PARENT -> METABOLITE
URINE
PARENT -> METABOLITE
FECAL
PARENT -> METABOLITE
PLASMA
Name Property Type Amount Referenced Substance Defining Parameters References
Tmax PHARMACOKINETIC