1,2,3,6-TETRAHYDRO-.ALPHA.,1,3-TRIMETHYL-2,6-DIOXO-7H-PURINE-7-PROPANOIC ACID

CC(CN1C=NC2=C1C(=O)N(C)C(=O)N2C)C(O)=O

InChIKey=VLQZZTPOLRMVJX-UHFFFAOYSA-N

InChI=1S/C11H14N4O4/c1-6(10(17)18)4-15-5-12-8-7(15)9(16)14(3)11(19)13(8)2/h5-6H,4H2,1-3H3,(H,17,18)

Stereochemistry	RACEMIC
Additional Stereochemistry	No
Defined Stereocenters	0 / 1
E/Z Centers	0
Optical Activity	( + / - )

Substance Class	Chemical Created by `admin` on `Wed Apr 02 08:16:22 GMT 2025` Edited by `admin` on `Wed Apr 02 08:16:22 GMT 2025`
Record UNII	NKW8AM0POK
Record Status	`Validated (UNII)`
Record Version

Name

Type

Language

1,2,3,6-TETRAHYDRO-.ALPHA.,1,3-TRIMETHYL-2,6-DIOXO-7H-PURINE-7-PROPANOIC ACID

Systematic Name

English

ISBUFYLLINE METABOLITE IV

Preferred Name

English

7H-PURINE-7-PROPANOIC ACID, 1,2,3,6-TETRAHYDRO-.ALPHA.,1,3-TRIMETHYL-2,6-DIOXO-

Systematic Name

English

Code System Code Type Description

CAS

153695-92-2

Created by admin on Wed Apr 02 08:16:22 GMT 2025 , Edited by admin on Wed Apr 02 08:16:22 GMT 2025

PRIMARY

FDA UNII

NKW8AM0POK

Created by admin on Wed Apr 02 08:16:22 GMT 2025 , Edited by admin on Wed Apr 02 08:16:22 GMT 2025

PRIMARY

PUBCHEM

54398406

Created by admin on Wed Apr 02 08:16:22 GMT 2025 , Edited by admin on Wed Apr 02 08:16:22 GMT 2025

PRIMARY

Related Record Type Details


					9C8Z5F38D0

PARENT -> METABOLITE

Qualification:

URINE