Vitas-M small molecule compound

methyl 2-[(7-dodecyl-6-hydroxy-3-methyl-2-oxo-3,7-dihydro-2H-purin-8-yl)sulfanyl]propanoate

Catalog ID
STL149357
SMILES CCCCCCCCCCCCn1c(SC(C(=O)OC)C)nc2c1c(O)nc(=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 C22H36N4O4S MW 452.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H36N4O4S/c1-5-6-7-8-9-10-11-12-13-14-15-26-17-18(25(3)21(29)24-19(17)27)23-22(26)31-16(2)20(28)30-4/h16H,5-15H2,1-4H3,(H,24,27,29)
InChIKey
WNTKONYUJCKNHN-UHFFFAOYSA-N
Synonyms
371213-64-8
371213648
MFCD03814594
ZINC000100692774
ZINC000100692777

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Available files

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