Vitas-M small molecule compound
(2E,9bR)-6-acetyl-7,9-dihydroxy-8,9b-dimethyl-2-(1-{[2-(1H-pyrazol-1-yl)ethyl]amino}ethylidene)dibenzo[b,d]furan-1,3(2H,9bH)-dione
Catalog ID
STL546270
SMILES C/C(=C\1/C(=O)C=C2[C@@](C1=O)(C)c1c(O)c(C)c(c(c1O2)C(=O)C)O)/NCCn1cccn1
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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 C23H23N3O6 MW 437.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H23N3O6/c1-11-19(29)17(13(3)27)21-18(20(11)30)23(4)15(32-21)10-14(28)16(22(23)31)12(2)24-7-9-26-8-5-6-25-26/h5-6,8,10,24,29-30H,7,9H2,1-4H3/b16-12+/t23-/m0/s1InChIKey
UZPBFEQLSCIAHU-DTPJYZGHSA-NSynonyms
(2~(E)9~(b)~(R))6acetyl79dihydroxy89~(b)dimethyl2(1(2pyrazol1ylethylamino)ethylidene)dibenzofuran13dione
(2E9bR)6acetyl79dihydroxy89bdimethyl2(1((2(1Hpyrazol1yl)ethyl)amino)ethylidene)dibenzo(bd)furan13(2H9bH)dione
(RE)2(1((2(1Hpyrazol1yl)ethyl)amino)ethylidene)6acetyl79dihydroxy89bdimethyldibenzo(bd)furan13(2H9bH)dione
110206192
CC(=C1C(=O)C=C2(C@@)(C1=O)(C)c1c(O)c(C)c(c(c1O2)C(=O)C)O)NCCn1cccn1
InChI=1SC23H23N3O6c11119(29)17(13(3)27)2118(20(11)30)23(4)15(3221)1014(28)16(22(23)31)12(2)2479268562526h56810242930H79H214H3b1612+t23m0s1
ZINC000253413520
ZINC253413520
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