Vitas-M small molecule compound
(2E,9bR)-6-acetyl-7,9-dihydroxy-2-(1-{[2-(hydroxymethyl)-1H-benzimidazol-6-yl]amino}ethylidene)-8,9b-dimethyldibenzo[b,d]furan-1,3(2H,9bH)-dione
Catalog ID
STL549933
SMILES OCc1[nH]c2c(n1)ccc(c2)N/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 C26H23N3O7 MW 489.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H23N3O7/c1-10-22(33)20(12(3)31)24-21(23(10)34)26(4)17(36-24)8-16(32)19(25(26)35)11(2)27-13-5-6-14-15(7-13)29-18(9-30)28-14/h5-8,27,30,33-34H,9H2,1-4H3,(H,28,29)/b19-11+/t26-/m0/s1InChIKey
GJQHRMGBIFIQGV-UXSCPUMKSA-NSynonyms
(2~(E)9~(b)~(R))6acetyl79dihydroxy2(1((2(hydroxymethyl)3~(H)benzimidazol5yl)amino)ethylidene)89~(b)dimethyldibenzofuran13dione
(2E9bR)6acetyl79dihydroxy2(1((2(hydroxymethyl)1Hbenzimidazol6yl)amino)ethylidene)89bdimethyldibenzo(bd)furan13(2H9bH)dione
(RE)6acetyl79dihydroxy2(1((2(hydroxymethyl)1Hbenzo(d)imidazol5yl)amino)ethylidene)89bdimethyldibenzo(bd)furan13(2H9bH)dione
132352204
InChI=1SC26H23N3O7c11022(33)20(12(3)31)2421(23(10)34)26(4)17(3624)816(32)19(25(26)35)11(2)2713561415(713)2918(930)2814h5827303334H9H214H3(H2829)b1911+t26m0s1
OCc1nc2c((nH)1)ccc(c2)NC(=C1C(=O)C=C2(C@@)(C1=O)(C)c1c(O)c(C)c(c(c1O2)C(=O)C)O)C
ZINC000828836720
Check stock
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Check stock on Vitas-MAvailable files
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