Vitas-M small molecule compound
(4E)-1-benzyl-5-(3-bromo-4-hydroxy-5-methoxyphenyl)-4-[hydroxy(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methylidene]pyrrolidine-2,3-dione
Catalog ID
STL054808
SMILES COc1cc(cc(c1O)Br)C1/C(=C(/c2ccc3c(c2)CC(O3)C)\O)/C(=O)C(=O)N1Cc1ccccc1
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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 C28H24BrNO6 MW 550.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H24BrNO6/c1-15-10-18-11-17(8-9-21(18)36-15)25(31)23-24(19-12-20(29)26(32)22(13-19)35-2)30(28(34)27(23)33)14-16-6-4-3-5-7-16/h3-9,11-13,15,24,31-32H,10,14H2,1-2H3/b25-23+InChIKey
AKMWKOGKGLHIMO-WJTDDFOZSA-NSynonyms
877788-80-2(4E)1benzyl5(3bromo4hydroxy5methoxyphenyl)4(hydroxy(2methyl23dihydro1benzofuran5yl)methylidene)pyrrolidine23dione
877788802
CC1CC2=C(O1)C=CC(=C2)C(=C3C(N(C(=O)C3=O)CC4=CC=CC=C4)C5=CC(=C(C(=C5)Br)O)OC)O
COc1cc(cc(c1O)Br)C1C(=C(c2ccc3c(c2)CC(O3)C)O)C(=O)C(=O)N1Cc1ccccc1
InChI=1SC28H24BrNO6c11510181117(8921(18)3615)25(31)2324(191220(29)26(32)22(1319)352)30(28(34)27(23)33)14166435716h39111315243132H1014H212H3b2523+
MFCD05731299
ZINC000102893567
ZINC000102893575
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