Vitas-M small molecule compound
[(7-heptyl-3-methyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)sulfanyl]acetic acid
Catalog ID
STK541109
SMILES CCCCCCCn1c(SCC(=O)O)nc2c1c(=O)[nH]c(=O)n2C
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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 C15H22N4O4S MW 354.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H22N4O4S/c1-3-4-5-6-7-8-19-11-12(16-15(19)24-9-10(20)21)18(2)14(23)17-13(11)22/h3-9H2,1-2H3,(H,20,21)(H,17,22,23)InChIKey
MXLJZBKRPAFYCB-UHFFFAOYSA-NSynonyms
331666-69-4((7heptyl3methyl26dioxo2367tetrahydro1Hpurin8yl)sulfanyl)aceticacid
2((7heptyl3methyl26dioxo2367tetrahydro1Hpurin8yl)thio)aceticacid
2(7HEPTYL3METHYL26DIOXOPURIN8YL)SULFANYLACETICACID
331666694
CCCCCCCn1c(SCC(=O)O)nc2c1c(=O)(nH)c(=O)n2C
CCCCCCCN1C2=C(N=C1SCC(=O)O)N(C(=O)NC2=O)C
InChI=1SC15H22N4O4Sc1345678191112(1615(19)24910(20)21)18(2)14(23)1713(11)22h39H212H3(H2021)(H172223)
MFCD00687848
ZINC000008396624
ZINC8396624
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