Vitas-M small molecule compound
(2E,9bR)-6-acetyl-7,9-dihydroxy-8,9b-dimethyl-2-{1-[(2-oxo-2H-chromen-6-yl)amino]ethylidene}dibenzo[b,d]furan-1,3(2H,9bH)-dione
Catalog ID
STL551273
SMILES O=c1ccc2c(o1)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 C27H21NO8 MW 487.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H21NO8/c1-11-23(32)21(13(3)29)25-22(24(11)33)27(4)18(36-25)10-16(30)20(26(27)34)12(2)28-15-6-7-17-14(9-15)5-8-19(31)35-17/h5-10,28,32-33H,1-4H3/b20-12+/t27-/m0/s1InChIKey
MFVAQSPRGTWKBB-LKCKWYFFSA-NSynonyms
(2~(E)9~(b)~(R))6acetyl79dihydroxy89~(b)dimethyl2(1((2oxochromen6yl)amino)ethylidene)dibenzofuran13dione
(2E9bR)6acetyl79dihydroxy89bdimethyl2(1((2oxo2Hchromen6yl)amino)ethylidene)dibenzo(bd)furan13(2H9bH)dione
(RE)6acetyl79dihydroxy89bdimethyl2(1((2oxo2Hchromen6yl)amino)ethylidene)dibenzo(bd)furan13(2H9bH)dione
127253893
InChI=1SC27H21NO8c11123(32)21(13(3)29)2522(24(11)33)27(4)18(3625)1016(30)20(26(27)34)12(2)2815671714(915)5819(31)3517h510283233H14H3b2012+t27m0s1
O=c1ccc2c(o1)ccc(c2)NC(=C1C(=O)C=C2(C@@)(C1=O)(C)c1c(O)c(C)c(c(c1O2)C(=O)C)O)C
ZINC000604404255
ZINC604404255
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