Vitas-M small molecule compound
1-({[(2Z)-2-(2,4-dimethoxybenzylidene)-3-oxo-2,3-dihydro-1-benzofuran-6-yl]oxy}acetyl)-4-hydroxy-L-proline
Catalog ID
STL529641
SMILES COc1cc(OC)ccc1/C=C/1\Oc2c(C1=O)ccc(c2)OCC(=O)N1CC(C[C@H]1C(=O)O)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 C24H23NO9 MW 469.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H23NO9/c1-31-15-4-3-13(19(9-15)32-2)7-21-23(28)17-6-5-16(10-20(17)34-21)33-12-22(27)25-11-14(26)8-18(25)24(29)30/h3-7,9-10,14,18,26H,8,11-12H2,1-2H3,(H,29,30)/b21-7-/t14?,18-/m0/s1InChIKey
KDTVAWRBRULBLS-AIJNZIJJSA-NSynonyms
(2~(S))1(2(((2~(Z))2((24dimethoxyphenyl)methylidene)3oxo1benzofuran6yl)oxy)acetyl)4hydroxypyrrolidine2carboxylicacid
(2S)1(2(((Z)2(24DIMETHOXYBENZYLIDENE)3OXO23DIHYDROBENZOFURAN6YL)OXY)ACETYL)4HYDROXYPYRROLIDINE2CARBOXYLICACID
1((((2Z)2(24dimethoxybenzylidene)3oxo23dihydro1benzofuran6yl)oxy)acetyl)4hydroxyLproline
16404002
COc1cc(OC)ccc1C=C1Oc2c(C1=O)ccc(c2)OCC(=O)N1CC(C(C@H)1C(=O)O)O
InChI=1SC24H23NO9c131154313(19(915)322)72123(28)176516(1020(17)3421)331222(27)251114(26)818(25)24(29)30h37910141826H81112H212H3(H2930)b217t14?18m0s1
ZINC000008790255
ZINC000012882482
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