Vitas-M small molecule compound
N-({[(2E)-3-oxo-2-(3,4,5-trimethoxybenzylidene)-2,3-dihydro-1-benzofuran-6-yl]oxy}acetyl)-L-aspartic acid
Catalog ID
STL532842
SMILES COc1cc(/C=C\2/Oc3c(C2=O)ccc(c3)OCC(=O)N[C@H](C(=O)O)CC(=O)O)cc(c1OC)OC
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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 C24H23NO11 MW 501.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H23NO11/c1-32-18-7-12(8-19(33-2)23(18)34-3)6-17-22(29)14-5-4-13(9-16(14)36-17)35-11-20(26)25-15(24(30)31)10-21(27)28/h4-9,15H,10-11H2,1-3H3,(H,25,26)(H,27,28)(H,30,31)/b17-6+/t15-/m0/s1InChIKey
LLBJCKPMQRGFSF-CVBXNJQQSA-NSynonyms
956989-26-7(2~(S))2((2(((2~(E))3oxo2((345trimethoxyphenyl)methylidene)1benzofuran6yl)oxy)acetyl)amino)butanedioicacid
(SE)2(2((3oxo2(345trimethoxybenzylidene)23dihydrobenzofuran6yl)oxy)acetamido)succinicacid
16406557
956989267
COc1cc(C=C2Oc3c(C2=O)ccc(c3)OCC(=O)N(C@H)(C(=O)O)CC(=O)O)cc(c1OC)OC
InChI=1SC24H23NO11c13218712(819(332)23(18)343)61722(29)145413(916(14)3617)351120(26)2515(24(30)31)1021(27)28h4915H1011H213H3(H2526)(H2728)(H3031)b176+t15m0s1
N((((2E)3oxo2(345trimethoxybenzylidene)23dihydro1benzofuran6yl)oxy)acetyl)Lasparticacid
ZINC000008876813
ZINC8876813
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