Vitas-M small molecule compound
methyl 4-{(3E)-3-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]-1-[3-(morpholin-4-yl)propyl]-4,5-dioxopyrrolidin-2-yl}benzoate
Catalog ID
STK611947
SMILES COC(=O)c1ccc(cc1)C1/C(=C(/c2ccc3c(c2)OCCO3)\O)/C(=O)C(=O)N1CCCN1CCOCC1
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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 C28H30N2O8 MW 522.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H30N2O8/c1-35-28(34)19-5-3-18(4-6-19)24-23(25(31)20-7-8-21-22(17-20)38-16-15-37-21)26(32)27(33)30(24)10-2-9-29-11-13-36-14-12-29/h3-8,17,24,31H,2,9-16H2,1H3/b25-23+InChIKey
HCWMIKKUSIOJFV-WJTDDFOZSA-NSynonyms
618408-83-6618408836
COC(=O)C1=CC=C(C=C1)C2C(=C(C3=CC4=C(C=C3)OCCO4)O)C(=O)C(=O)N2CCCN5CCOCC5
COC(=O)c1ccc(cc1)C1C(=C(c2ccc3c(c2)OCCO3)O)C(=O)C(=O)N1CCCN1CCOCC1
InChI=1SC28H30N2O8c13528(34)195318(4619)2423(25(31)20782122(1720)3816153721)26(32)27(33)30(24)102929111336141229h38172431H2916H21H3b2523+
methyl4((3E)3(23dihydro14benzodioxin6yl(hydroxy)methylidene)1(3(morpholin4yl)propyl)45dioxopyrrolidin2yl)benzoate
METHYL4((3E)3(23DIHYDRO14BENZODIOXIN6YL(HYDROXY)METHYLIDENE)1(3MORPHOLIN4YLPROPYL)45DIOXOPYRROLIDIN2YL)BENZOATE
METHYL4(3(2H3HBENZO(34E)14DIOXAN6YLCARBONYL)4HYDROXY1(3MORPHOLIN4YLPROPYL)5OXO3PYRROLIN2YL)BENZOATE
MFCD08734549
ZINC000102709474
ZINC000102709478
Check stock
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Check stock on Vitas-MAvailable files
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