Vitas-M small molecule compound
(2E,9bR)-6-acetyl-2-{1-[(4-chlorobenzyl)amino]ethylidene}-7,9-dihydroxy-8,9b-dimethyldibenzo[b,d]furan-1,3(2H,9bH)-dione
Catalog ID
STL546835
SMILES Clc1ccc(cc1)CN/C(=C/1\C(=O)C=C2[C@@](C1=O)(C)c1c(O)c(C)c(c(c1O2)C(=O)C)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 C25H22ClNO6 MW 467.91 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H22ClNO6/c1-11-21(30)19(13(3)28)23-20(22(11)31)25(4)17(33-23)9-16(29)18(24(25)32)12(2)27-10-14-5-7-15(26)8-6-14/h5-9,27,30-31H,10H2,1-4H3/b18-12+/t25-/m0/s1InChIKey
ZKDJGXQSYDJLOZ-QAKGTIEWSA-NSynonyms
(2~(E)9~(b)~(R))6acetyl2(1((4chlorophenyl)methylamino)ethylidene)79dihydroxy89~(b)dimethyldibenzofuran13dione
(2E9bR)6acetyl2(1((4chlorobenzyl)amino)ethylidene)79dihydroxy89bdimethyldibenzo(bd)furan13(2H9bH)dione
(RE)6acetyl2(1((4chlorobenzyl)amino)ethylidene)79dihydroxy89bdimethyldibenzo(bd)furan13(2H9bH)dione
110207673
Clc1ccc(cc1)CNC(=C1C(=O)C=C2(C@@)(C1=O)(C)c1c(O)c(C)c(c(c1O2)C(=O)C)O)C
InChI=1SC25H22ClNO6c11121(30)19(13(3)28)2320(22(11)31)25(4)17(3323)916(29)18(24(25)32)12(2)2710145715(26)8614h59273031H10H214H3b1812+t25m0s1
ZINC000253415026
ZINC253415026
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