Vitas-M small molecule compound
4-butyl-7-methyl-2-oxo-2H-chromen-5-yl N-[(benzyloxy)carbonyl]-D-alaninate
Catalog ID
STL531875
SMILES CCCCc1cc(=O)oc2c1c(OC(=O)[C@H](NC(=O)OCc1ccccc1)C)cc(c2)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 C25H27NO6 MW 437.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H27NO6/c1-4-5-11-19-14-22(27)31-20-12-16(2)13-21(23(19)20)32-24(28)17(3)26-25(29)30-15-18-9-7-6-8-10-18/h6-10,12-14,17H,4-5,11,15H2,1-3H3,(H,26,29)/t17-/m1/s1InChIKey
ATDUYAJPCYXUEC-QGZVFWFLSA-NSynonyms
(4butyl7methyl2oxochromen5yl)(2~(R))2(phenylmethoxycarbonylamino)propanoate
(S)4butyl7methyl2oxo2Hchromen5yl2(((benzyloxy)carbonyl)amino)propanoate
1751121
4butyl7methyl2oxo2Hchromen5ylN((benzyloxy)carbonyl)Dalaninate
CCCCc1cc(=O)oc2c1c(OC(=O)(C@@H)(NC(=O)OCc1ccccc1)C)cc(c2)C
InChI=1SC25H27NO6c14511191422(27)31201216(2)1321(23(19)20)3224(28)17(3)2625(29)30151897681018h610121417H451115H213H3(H2629)t17m1s1
ZINC000016042606
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