Vitas-M small molecule compound
2-({(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)ethanesulfonamide
Catalog ID
STL548337
SMILES C/C(=C\1/C(=O)C=C2[C@@](C1=O)(C)c1c(O)c(C)c(c(c1O2)C(=O)C)O)/NCCS(=O)(=O)N
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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 C20H22N2O8S MW 450.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H22N2O8S/c1-8-16(25)14(10(3)23)18-15(17(8)26)20(4)12(30-18)7-11(24)13(19(20)27)9(2)22-5-6-31(21,28)29/h7,22,25-26H,5-6H2,1-4H3,(H2,21,28,29)/b13-9+/t20-/m0/s1InChIKey
IEUQVYQEWZSJNI-SQSZOCELSA-NSynonyms
(RE)2((1(6acetyl79dihydroxy89bdimethyl13dioxo19bdihydrodibenzo(bd)furan2(3H)ylidene)ethyl)amino)ethanesulfonamide
110207434
2(((1~(E))1((9~(b)~(R))6acetyl79dihydroxy89~(b)dimethyl13dioxodibenzofuran2ylidene)ethyl)amino)ethanesulfonamide
2(((1E)1((9bR)6acetyl79dihydroxy89bdimethyl13dioxo39bdihydrodibenzo(bd)furan2(1H)ylidene)ethyl)amino)ethanesulfonamide
CC(=C1C(=O)C=C2(C@@)(C1=O)(C)c1c(O)c(C)c(c(c1O2)C(=O)C)O)NCCS(=O)(=O)N
InChI=1SC20H22N2O8Sc1816(25)14(10(3)23)1815(17(8)26)20(4)12(3018)711(24)13(19(20)27)9(2)225631(2128)29h7222526H56H214H3(H2212829)b139+t20m0s1
ZINC000253405277
ZINC253405277
Check stock
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