Vitas-M small molecule compound
7-chloro-6'-hydroxy-4,6-dimethoxy-5'-{4-methoxy-3-[(2-methylprop-2-en-1-yl)oxy]phenyl}-1',3',8'-trimethyl-1',5',8',9'-tetrahydro-2'H,3H-spiro[1-benzofuran-2,7'-pyrimido[4,5-b]quinoline]-2',3,4'(3'H)-trione
Catalog ID
STL550470
SMILES COc1ccc(cc1OCC(=C)C)C1c2c(N=C3C1=C(O)C1(C(C3)C)Oc3c(C1=O)c(OC)cc(c3Cl)OC)n(C)c(=O)n(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 C34H34ClN3O9 MW 664.11 g/mol Purity >90% as per NMR
InChI
InChI=1S/C34H34ClN3O9/c1-15(2)14-46-20-12-17(9-10-19(20)43-6)23-24-18(36-31-26(23)32(41)38(5)33(42)37(31)4)11-16(3)34(29(24)39)30(40)25-21(44-7)13-22(45-8)27(35)28(25)47-34/h9-10,12-13,16,23,39H,1,11,14H2,2-8H3InChIKey
UGDVSGHSRKGXSR-UHFFFAOYSA-NSynonyms
7chloro6hydroxy46dimethoxy5(4methoxy3((2methylprop2en1yl)oxy)phenyl)138trimethyl1589tetrahydro2H3Hspiro(1benzofuran27pyrimido(45b)quinoline)234(3H)trione
InChI=1SC34H34ClN3O9c115(2)1446201217(91019(20)436)232418(363126(23)32(41)38(5)33(42)37(31)4)1116(3)34(29(24)39)30(40)2521(447)1322(458)27(35)28(25)4734h9101213162339H11114H228H3
MFCD31757606
ZINC000888089298
ZINC000888089301
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