1,2,3,6-Tetrahydro-1,3-dimethyl-2,6-dioxo-7H-purine-7-propanesulfonic acid

CN1C2=C(N(CCCS(O)(=O)=O)C=N2)C(=O)N(C)C1=O

InChIKey=RSTSVFVCHWLPHQ-UHFFFAOYSA-N

InChI=1S/C10H14N4O5S/c1-12-8-7(9(15)13(2)10(12)16)14(6-11-8)4-3-5-20(17,18)19/h6H,3-5H2,1-2H3,(H,17,18,19)

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Substance Class	Chemical Created by `admin` on `Tue Apr 01 19:07:13 GMT 2025` Edited by `admin` on `Tue Apr 01 19:07:13 GMT 2025`
Record UNII	Y8MLS4HKX7
Record Status	`Validated (UNII)`
Record Version

Name

Type

Language

1-(7-Theophyllinyl)-3-propanesulfonic acid

Preferred Name

English

1,2,3,6-Tetrahydro-1,3-dimethyl-2,6-dioxo-7H-purine-7-propanesulfonic acid

Systematic Name

English

7H-Purine-7-propanesulfonic acid, 1,2,3,6-tetrahydro-1,3-dimethyl-2,6-dioxo-

Systematic Name

English

Code System Code Type Description

EPA CompTox

DTXSID40168239