Vitas-M small molecule compound
N-[(2S)-1-hydroxy-4-(methylsulfanyl)butan-2-yl]-2-[(4,8,8-trimethyl-2-oxo-9,10-dihydro-2H,8H-pyrano[2,3-f]chromen-5-yl)oxy]acetamide
Catalog ID
STL533848
SMILES CSCC[C@H](NC(=O)COc1cc2OC(C)(C)CCc2c2c1c(C)cc(=O)o2)CO
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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 C22H29NO6S MW 435.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H29NO6S/c1-13-9-19(26)28-21-15-5-7-22(2,3)29-16(15)10-17(20(13)21)27-12-18(25)23-14(11-24)6-8-30-4/h9-10,14,24H,5-8,11-12H2,1-4H3,(H,23,25)/t14-/m0/s1InChIKey
YDTSSYCTIGBFBS-AWEZNQCLSA-NSynonyms
956917-18-3(S)N(1hydroxy4(methylthio)butan2yl)2((488trimethyl2oxo28910tetrahydropyrano(23f)chromen5yl)oxy)acetamide
~(N)((2~(S))1hydroxy4methylsulfanylbutan2yl)2((488trimethyl2oxo910dihydropyrano(23h)chromen5yl)oxy)acetamide
16408142
956917183
CSCC(C@H)(NC(=O)COc1cc2OC(C)(C)CCc2c2c1c(C)cc(=O)o2)CO
InChI=1SC22H29NO6Sc113919(26)2821155722(23)2916(15)1017(20(13)21)271218(25)2314(1124)68304h9101424H581112H214H3(H2325)t14m0s1
N((2S)1hydroxy4(methylsulfanyl)butan2yl)2((488trimethyl2oxo910dihydro2H8Hpyrano(23f)chromen5yl)oxy)acetamide
ZINC000012894293
ZINC12894293
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