Vitas-M small molecule compound
6-hydroxy-7-(2-hydroxy-3-phenoxypropyl)-3-methyl-8-(prop-2-en-1-ylsulfanyl)-3,7-dihydro-2H-purin-2-one
Catalog ID
STK632669
SMILES C=CCSc1nc2c(n1CC(COc1ccccc1)O)c(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 C18H20N4O4S MW 388.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H20N4O4S/c1-3-9-27-18-19-15-14(16(24)20-17(25)21(15)2)22(18)10-12(23)11-26-13-7-5-4-6-8-13/h3-8,12,23H,1,9-11H2,2H3,(H,20,24,25)InChIKey
TWHSFWIFSNBXQY-UHFFFAOYSA-NSynonyms
331675-53-7331675537
6hydroxy7(2hydroxy3phenoxypropyl)3methyl8(prop2en1ylsulfanyl)37dihydro2Hpurin2one
7(2HYDROXY3PHENOXYPROPYL)3METHYL8PROP2ENYLSULFANYLPURINE26DIONE
7(2HYDROXY3PHENOXYPROPYL)3METHYL8PROP2ENYLTHIO137TRIHYDROPURINE26DIONE
CN1C2=C(C(=O)NC1=O)N(C(=N2)SCC=C)CC(COC3=CC=CC=C3)O
InChI=1SC18H20N4O4Sc1392718191514(16(24)2017(25)21(15)2)22(18)1012(23)1126137546813h381223H1911H22H3(H202425)
MFCD18159850
ZINC000003109212
ZINC000003109213
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