Vitas-M small molecule compound
N-({[(2Z)-2-(3,4-dimethoxybenzylidene)-3-oxo-2,3-dihydro-1-benzofuran-6-yl]oxy}acetyl)-L-valine
Catalog ID
STL529736
SMILES COc1cc(ccc1OC)/C=C/1\Oc2c(C1=O)ccc(c2)OCC(=O)N[C@H](C(=O)O)C(C)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 C24H25NO8 MW 455.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H25NO8/c1-13(2)22(24(28)29)25-21(26)12-32-15-6-7-16-18(11-15)33-20(23(16)27)10-14-5-8-17(30-3)19(9-14)31-4/h5-11,13,22H,12H2,1-4H3,(H,25,26)(H,28,29)/b20-10-/t22-/m0/s1InChIKey
XGYNLFPWNIXKOF-OFHGOEMBSA-NSynonyms
956949-33-0(2~(S))2((2(((2~(Z))2((34dimethoxyphenyl)methylidene)3oxo1benzofuran6yl)oxy)acetyl)amino)3methylbutanoicacid
(SZ)2(2((2(34dimethoxybenzylidene)3oxo23dihydrobenzofuran6yl)oxy)acetamido)3methylbutanoicacid
16403857
956949330
COc1cc(ccc1OC)C=C1Oc2c(C1=O)ccc(c2)OCC(=O)N(C@H)(C(=O)O)C(C)C
InChI=1SC24H25NO8c113(2)22(24(28)29)2521(26)123215671618(1115)3320(23(16)27)10145817(303)19(914)314h5111322H12H214H3(H2526)(H2829)b2010t22m0s1
N((((2Z)2(34dimethoxybenzylidene)3oxo23dihydro1benzofuran6yl)oxy)acetyl)Lvaline
ZINC000008790132
ZINC8790132
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