Vitas-M small molecule compound
(2E)-9-(6-bromo-4H-1,3-benzodioxin-8-yl)-2-(4-methoxybenzylidene)-8,9-dihydro-7H-furo[2,3-f]chromene-3,7(2H)-dione
Catalog ID
STL543698
SMILES COc1ccc(cc1)/C=C\1/Oc2c(C1=O)ccc1c2C(CC(=O)O1)c1cc(Br)cc2c1OCOC2
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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 C27H19BrO7 MW 535.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H19BrO7/c1-31-17-4-2-14(3-5-17)8-22-25(30)18-6-7-21-24(27(18)35-22)19(11-23(29)34-21)20-10-16(28)9-15-12-32-13-33-26(15)20/h2-10,19H,11-13H2,1H3/b22-8+InChIKey
ASDJEMNJUNRMLE-GZIVZEMBSA-NSynonyms
1630907-48-0(2~(E))9(6bromo4~(H)13benzodioxin8yl)2((4methoxyphenyl)methylidene)89dihydrofuro(23f)chromene37dione
(2E)9(6bromo4H13benzodioxin8yl)2(4methoxybenzylidene)89dihydro7Hfuro(23f)chromene37(2H)dione
(Z)9(6bromo4Hbenzo(d)(13)dioxin8yl)2(4methoxybenzylidene)89dihydro2Hfuro(23f)chromene37dione
1630907480
91636582
COc1ccc(cc1)C=C1Oc2c(C1=O)ccc1c2C(CC(=O)O1)c1cc(Br)cc2c1OCOC2
InChI=1SC27H19BrO7c131174214(3517)82225(30)18672124(27(18)3522)19(1123(29)3421)201016(28)9151232133326(15)20h21019H1113H21H3b228+
MFCD28348796
ZINC000217612583
ZINC000217612678
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