Vitas-M small molecule compound

3-(1,3-dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-9-ium-8-yl)phenolate

Catalog ID
STK569799
SMILES [O-]c1cccc(c1)c1[nH]c2c([nH+]1)n(C)c(=O)n(c2=O)C

Contact us by email for worldwide delivery information, pricing, and real‑time availability. Send us your quotation request, and we will confirm stock levels, provide exact costs and lead times, suggest alternatives or find analogs when helpful, and share any additional specifications you may need.

We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C13H12N4O3 MW 272.26 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H12N4O3/c1-16-11-9(12(19)17(2)13(16)20)14-10(15-11)7-4-3-5-8(18)6-7/h3-6,18H,1-2H3,(H,14,15)
InChIKey
UZPPSCQEEUUJSB-UHFFFAOYSA-N
Synonyms
85872-68-0
(O)c1cccc(c1)c1(nH)c2c((nH+)1)n(C)c(=O)n(c2=O)C
3(13dimethyl26dioxo2367tetrahydro1Hpurin9ium8yl)phenolate
8(3HYDROXYPHENYL)13DIMETHYL37DIHYDRO1HPURINE26DIONE
8(3HYDROXYPHENYL)13DIMETHYL37DIHYDROPURINE26DIONE
8(3HYDROXYPHENYL)13DIMETHYL7HPURINE26DIONE
85872680
CN1C2=C(C(=O)N(C1=O)C)NC(=N2)C3=CC(=CC=C3)O
InChI=1SC13H12N4O3c116119(12(19)17(2)13(16)20)1410(1511)74358(18)67h3618H12H3(H1415)
MFCD04011603
ZINC000004019690
ZINC04019690
ZINC4019690

Check stock

See real-time availability and sample size for STK569799 on the Vitas-M platform.

Check stock on Vitas-M

Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.