2,3,6,9-Tetrahydro-1,3-dimethyl-2,6-dioxo-1H-purine-8-butanoic acid
CAS Registry Number®
5438-71-1
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CAS Name
2,3,6,9-Tetrahydro-1,3-dimethyl-2,6-dioxo-1H-purine-8-butanoic acidMolecular Formula
C11H14N4O4Molecular Mass
266.25Cite this Page
2,3,6,9-Tetrahydro-1,3-dimethyl-2,6-dioxo-1H-purine-8-butanoic acid. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=5438-71-1 (retrieved ) (CAS RN: 5438-71-1). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Other Names and Identifiers
InChI
InChI=1S/C11H14N4O4/c1-14-9-8(10(18)15(2)11(14)19)12-6(13-9)4-3-5-7(16)17/h3-5H2,1-2H3,(H,12,13)(H,16,17)
InChIKey
InChIKey=NGBYKZGOXFIONW-UHFFFAOYSA-N
SMILES
O=C1C2=C(N(C)C(=O)N1C)N=C(CCCC(O)=O)N2
Canonical SMILES
O=C(O)CCCC1=NC2=C(N1)C(=O)N(C(=O)N2C)C
Other Names for this Substance
- 1H-Purine-8-butanoic acid, 2,3,6,9-tetrahydro-1,3-dimethyl-2,6-dioxo-
- 1H-Purine-8-butanoic acid, 2,3,6,7-tetrahydro-1,3-dimethyl-2,6-dioxo-
- 2,3,6,9-Tetrahydro-1,3-dimethyl-2,6-dioxo-1H-purine-8-butanoic acid
- 8-(3-Carboxypropyl)theophylline
- 8-(3-Carboxypropyl)-1,3-dimethylxanthine
