Vitas-M small molecule compound
methyl 4-{(Z)-[6-hydroxy-7-{[4-(2-hydroxyethyl)piperazin-1-yl]methyl}-4-methyl-3-oxo-1-benzofuran-2(3H)-ylidene]methyl}benzoate
Catalog ID
STK992199
SMILES OCCN1CCN(CC1)Cc1c(O)cc(c2c1O/C(=C\c1ccc(cc1)C(=O)OC)/C2=O)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 C25H28N2O6 MW 452.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H28N2O6/c1-16-13-20(29)19(15-27-9-7-26(8-10-27)11-12-28)24-22(16)23(30)21(33-24)14-17-3-5-18(6-4-17)25(31)32-2/h3-6,13-14,28-29H,7-12,15H2,1-2H3/b21-14-InChIKey
WWCFLLMNAQUGBR-STZFKDTASA-NSynonyms
903202-92-6(2Z)7((4(2hydroxyethyl)piperazin1ium1yl)methyl)2((4methoxycarbonylphenyl)methylidene)4methyl3oxo1benzofuran6olate
(Z)methyl4((6hydroxy7((4(2hydroxyethyl)piperazin1yl)methyl)4methyl3oxobenzofuran2(3H)ylidene)methyl)benzoate
903202926
CC1=CC(=C(C2=C1C(=O)C(=CC3=CC=C(C=C3)C(=O)OC)O2)C(NH+)4CCN(CC4)CCO)(O)
InChI=1SC25H28N2O6c1161320(29)19(15279726(81027)111228)2422(16)23(30)21(3324)14173518(6417)25(31)322h3613142829H71215H212H3b2114
methyl4((Z)(6hydroxy7((4(2hydroxyethyl)piperazin1yl)methyl)4methyl3oxo1benzofuran2(3H)ylidene)methyl)benzoate
OCCN1CCN(CC1)Cc1c(O)cc(c2c1OC(=Cc1ccc(cc1)C(=O)OC)C2=O)C
Check stock
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