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Details

Stereochemistry RACEMIC
Molecular Formula C19H25N5O6
Molecular Weight 419.4317
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 4-AMINO-2-(4-(4-CARBOXY-2-HYDROXYBUTANOYL)-1-PIPERAZINYL)-6,7-DIMETHOXYQUINAZOLINE

SMILES

COC1=CC2=NC(=NC(N)=C2C=C1OC)N3CCN(CC3)C(=O)C(O)CCC(O)=O

InChI

InChIKey=KVVYXJVMMZWOOR-UHFFFAOYSA-N
InChI=1S/C19H25N5O6/c1-29-14-9-11-12(10-15(14)30-2)21-19(22-17(11)20)24-7-5-23(6-8-24)18(28)13(25)3-4-16(26)27/h9-10,13,25H,3-8H2,1-2H3,(H,26,27)(H2,20,21,22)

HIDE SMILES / InChI

Molecular Formula C19H25N5O6
Molecular Weight 419.4317
Charge 0
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 10:48:17 GMT 2023
Edited
by admin
on Sat Dec 16 10:48:17 GMT 2023
Record UNII
48ZH8CHN6M
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
4-AMINO-2-(4-(4-CARBOXY-2-HYDROXYBUTANOYL)-1-PIPERAZINYL)-6,7-DIMETHOXYQUINAZOLINE
Systematic Name English
1-PIPERAZINEPENTANOIC ACID, 4-(4-AMINO-6,7-DIMETHOXY-2-QUINAZOLINYL)-.GAMMA.-HYDROXY-.DELTA.-OXO-
Systematic Name English
Code System Code Type Description
CAS
110518-89-3
Created by admin on Sat Dec 16 10:48:17 GMT 2023 , Edited by admin on Sat Dec 16 10:48:17 GMT 2023
PRIMARY
FDA UNII
48ZH8CHN6M
Created by admin on Sat Dec 16 10:48:17 GMT 2023 , Edited by admin on Sat Dec 16 10:48:17 GMT 2023
PRIMARY
PUBCHEM
91810601
Created by admin on Sat Dec 16 10:48:17 GMT 2023 , Edited by admin on Sat Dec 16 10:48:17 GMT 2023
PRIMARY
Related Record Type Details
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