Vitas-M small molecule compound
5-(6-amino-1,3-dimethyl-2,4-dioxo-1,2,3,4-tetrahydropyrimidin-5-yl)-6-(4-hydroxy-3-methoxyphenyl)-1,3-dimethyl-1H-pyrrolo[2,3-d]pyrimidine-2,4(3H,7H)-dione
Catalog ID
STL236974
SMILES COc1cc(ccc1O)c1[nH]c2c(c1c1c(N)n(C)c(=O)n(c1=O)C)c(=O)n(c(=O)n2C)C
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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 C21H22N6O6 MW 454.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22N6O6/c1-24-16(22)13(18(29)26(3)20(24)31)12-14-17(25(2)21(32)27(4)19(14)30)23-15(12)9-6-7-10(28)11(8-9)33-5/h6-8,23,28H,22H2,1-5H3InChIKey
JBIZJPYTSMHIOJ-UHFFFAOYSA-NSynonyms
951975-21-65(4amino13dimethyl26dioxopyrimidin5yl)6(4hydroxy3methoxyphenyl)13dimethyl7Hpyrrolo(23d)pyrimidine24dione
5(6amino13dimethyl24dioxo1234tetrahydropyrimidin5yl)6(4hydroxy3methoxyphenyl)13dimethyl1Hpyrrolo(23d)pyrimidine24(3H7H)dione
951975216
CN1C(=C(C(=O)N(C1=O)C)C2=C(NC3=C2C(=O)N(C(=O)N3C)C)C4=CC(=C(C=C4)O)OC)N
COc1cc(ccc1O)c1(nH)c2c(c1c1c(N)n(C)c(=O)n(c1=O)C)c(=O)n(c(=O)n2C)C
InChI=1SC21H22N6O6c12416(22)13(18(29)26(3)20(24)31)121417(25(2)21(32)27(4)19(14)30)2315(12)96710(28)11(89)335h682328H22H215H3
MFCD09857697
ZINC000013731226
ZINC13731226
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