Vitas-M small molecule compound
(2E,9bR)-6-acetyl-2-(1-{[2-(5-fluoro-2-oxo-2,3-dihydro-1H-indol-3-yl)ethyl]amino}ethylidene)-7,9-dihydroxy-8,9b-dimethyldibenzo[b,d]furan-1,3(2H,9bH)-dione
Catalog ID
STL548103
SMILES Fc1ccc2c(c1)C(CCN/C(=C/1\C(=O)C=C3[C@@](C1=O)(C)c1c(O)c(C)c(c(c1O3)C(=O)C)O)/C)C(=O)N2
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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 C28H25FN2O7 MW 520.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H25FN2O7/c1-11-23(34)21(13(3)32)25-22(24(11)35)28(4)19(38-25)10-18(33)20(26(28)36)12(2)30-8-7-15-16-9-14(29)5-6-17(16)31-27(15)37/h5-6,9-10,15,30,34-35H,7-8H2,1-4H3,(H,31,37)/b20-12+/t15?,28-/m0/s1InChIKey
IBCRQYKNCCUPHS-QKVGDKRLSA-NSynonyms
(2~(E)9~(b)~(R))6acetyl2(1(2(5fluoro2oxo13dihydroindol3yl)ethylamino)ethylidene)79dihydroxy89~(b)dimethyldibenzofuran13dione
(2E9bR)6acetyl2(1((2(5fluoro2oxo23dihydro1Hindol3yl)ethyl)amino)ethylidene)79dihydroxy89bdimethyldibenzo(bd)furan13(2H9bH)dione
(9bRE)6acetyl2(1((2(5fluoro2oxoindolin3yl)ethyl)amino)ethylidene)79dihydroxy89bdimethyldibenzo(bd)furan13(2H9bH)dione
110206476
Fc1ccc2c(c1)C(CCNC(=C1C(=O)C=C3(C@@)(C1=O)(C)c1c(O)c(C)c(c(c1O3)C(=O)C)O)C)C(=O)N2
InChI=1SC28H25FN2O7c11123(34)21(13(3)32)2522(24(11)35)28(4)19(3825)1018(33)20(26(28)36)12(2)30871516914(29)5617(16)3127(15)37h5691015303435H78H214H3(H3137)b2012+t15?28m0s1
ZINC000253404992
ZINC000253404994
Check stock
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Check stock on Vitas-MAvailable files
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