Vitas-M small molecule compound
methyl N-[3-(4,11-dimethyl-2-oxo-6,7,8,9-tetrahydro-2H-[1]benzofuro[3,2-g]chromen-3-yl)propanoyl]-D-alaninate
Catalog ID
STL476513
SMILES COC(=O)[C@H](NC(=O)CCc1c(=O)oc2c(c1C)cc1c(c2C)oc2c1CCCC2)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 C24H27NO6 MW 425.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H27NO6/c1-12-15(9-10-20(26)25-14(3)23(27)29-4)24(28)31-21-13(2)22-18(11-17(12)21)16-7-5-6-8-19(16)30-22/h11,14H,5-10H2,1-4H3,(H,25,26)/t14-/m1/s1InChIKey
ZHTKXJUNEFLTET-CQSZACIVSA-NSynonyms
1630916-76-5(R)methyl2(3(411dimethyl2oxo6789tetrahydro2Hbenzofuro(32g)chromen3yl)propanamido)propanoate
1630916765
CC1=C(C(=O)OC2=C1C=C3C4=C(CCCC4)OC3=C2C)CCC(=O)NC(C)C(=O)OC
COC(=O)(C@H)(NC(=O)CCc1c(=O)oc2c(c1C)cc1c(c2C)oc2c1CCCC2)C
InChI=1SC24H27NO6c11215(91020(26)2514(3)23(27)294)24(28)312113(2)2218(1117(12)21)16756819(16)3022h1114H510H214H3(H2526)t14m1s1
methyl(2R)2(3(411dimethyl2oxo6789tetrahydro(1)benzofuro(32g)chromen3yl)propanoylamino)propanoate
methylN(3(411dimethyl2oxo6789tetrahydro2H(1)benzofuro(32g)chromen3yl)propanoyl)Dalaninate
ZINC000170625772
ZINC170625772
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