Vitas-M small molecule compound
4-({(1E)-1-[(9bR)-6-acetyl-7,9-dihydroxy-8,9b-dimethyl-1,3-dioxo-3,9b-dihydrodibenzo[b,d]furan-2(1H)-ylidene]ethyl}amino)-3-hydroxybenzenesulfonamide
Catalog ID
STL551451
SMILES O=C1C=C2Oc3c([C@]2(C(=O)/C/1=C(/Nc1ccc(cc1O)S(=O)(=O)N)\C)C)c(O)c(c(c3C(=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 C24H22N2O9S MW 514.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H22N2O9S/c1-9-20(30)18(11(3)27)22-19(21(9)31)24(4)16(35-22)8-15(29)17(23(24)32)10(2)26-13-6-5-12(7-14(13)28)36(25,33)34/h5-8,26,28,30-31H,1-4H3,(H2,25,33,34)/b17-10+/t24-/m0/s1InChIKey
KSJKCWYNZWNRMH-GOOYREHVSA-NSynonyms
(RE)4((1(6acetyl79dihydroxy89bdimethyl13dioxo19bdihydrodibenzo(bd)furan2(3H)ylidene)ethyl)amino)3hydroxybenzenesulfonamide
132351833
4(((1~(E))1((9~(b)~(R))6acetyl79dihydroxy89~(b)dimethyl13dioxodibenzofuran2ylidene)ethyl)amino)3hydroxybenzenesulfonamide
4(((1E)1((9bR)6acetyl79dihydroxy89bdimethyl13dioxo39bdihydrodibenzo(bd)furan2(1H)ylidene)ethyl)amino)3hydroxybenzenesulfonamide
InChI=1SC24H22N2O9Sc1920(30)18(11(3)27)2219(21(9)31)24(4)16(3522)815(29)17(23(24)32)10(2)26136512(714(13)28)36(2533)34h5826283031H14H3(H2253334)b1710+t24m0s1
O=C1C=C2Oc3c((C@)2(C(=O)C1=C(Nc1ccc(cc1O)S(=O)(=O)N)C)C)c(O)c(c(c3C(=O)C)O)C
ZINC000828237974
Check stock
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