Vitas-M small molecule compound
5-(2-acetyl-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)-3-[2-(3,4-dimethoxyphenyl)ethyl]-6-hydroxypyrimidine-2,4(1H,3H)-dione
Catalog ID
STL527797
SMILES COc1cc(ccc1OC)CCn1c(=O)[nH]c(c(c1=O)C1N(CCc2c1cc(OC)c(c2)OC)C(=O)C)O
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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 C27H31N3O8 MW 525.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H31N3O8/c1-15(31)29-11-9-17-13-21(37-4)22(38-5)14-18(17)24(29)23-25(32)28-27(34)30(26(23)33)10-8-16-6-7-19(35-2)20(12-16)36-3/h6-7,12-14,24,32H,8-11H2,1-5H3,(H,28,34)InChIKey
UYNKLYCUFZZAKN-UHFFFAOYSA-NSynonyms
5(2acetyl67dimethoxy1234tetrahydroisoquinolin1yl)3(2(34dimethoxyphenyl)ethyl)6hydroxypyrimidine24(1H3H)dione
5(2acetyl67dimethoxy1234tetrahydroisoquinolin1yl)3(34dimethoxyphenethyl)6hydroxypyrimidine24(1H3H)dione
COc1cc(ccc1OC)CCn1c(=O)(nH)c(c(c1=O)C1N(CCc2c1cc(OC)c(c2)OC)C(=O)C)O
InChI=1SC27H31N3O8c115(31)29119171321(374)22(385)1418(17)24(29)2325(32)2827(34)30(26(23)33)108166719(352)20(1216)363h6712142432H811H215H3(H2834)
MFCD03660977
ZINC000012661575
ZINC000100749908
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