Vitas-M small molecule compound
(8Z,8'E)-8,8'-bis{[(2,6-dimethylphenyl)amino]methylidene}-1,1',6,6'-tetrahydroxy-3,3'-dimethyl-5,5'-di(propan-2-yl)-2,2'-binaphthalene-7,7'(8H,8'H)-dione
Catalog ID
STL514083
SMILES CC(C1=C(O)C(=O)/C(=C/Nc2c(C)cccc2C)/c2c1cc(C)c(c2O)c1c(C)cc2c(c1O)/C(=C/Nc1c(C)cccc1C)/C(=O)C(=C2C(C)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 C46H48N2O6 MW 724.90 g/mol Purity >90% as per NMR
InChI
InChI=1S/C46H48N2O6/c1-21(2)33-29-17-27(9)35(43(51)37(29)31(41(49)45(33)53)19-47-39-23(5)13-11-14-24(39)6)36-28(10)18-30-34(22(3)4)46(54)42(50)32(38(30)44(36)52)20-48-40-25(7)15-12-16-26(40)8/h11-22,47-48,51-54H,1-10H3/b31-19-,32-20+InChIKey
YWJYSUBSSNQNNW-QXLZFTBOSA-NSynonyms
(1~(Z))1((26dimethylanilino)methylidene)7((8~(E))8((26dimethylanilino)methylidene)16dihydroxy3methyl7oxo5propan2ylnaphthalen2yl)38dihydroxy6methyl4propan2ylnaphthalen2one
(1E)1((26DIMETHYLANILINO)METHYLIDENE)7((8Z)8((26DIMETHYLANILINO)METHYLIDENE)16DIHYDROXY3METHYL7OXO5PROPAN2YLNAPHTHALEN2YL)38DIHYDROXY6METHYL4PROPAN2YLNAPHTHALEN2ONE
(8Z8E)88bis(((26dimethylphenyl)amino)methylidene)1166tetrahydroxy33dimethyl55di(propan2yl)22binaphthalene77(8H8H)dione
5900230
InChI=1SC46H48N2O6c121(2)33291727(9)35(43(51)37(29)31(41(49)45(33)53)19473923(5)13111424(39)6)3628(10)183034(22(3)4)46(54)42(50)32(38(30)44(36)52)20484025(7)15121626(40)8h112247485154H110H3b31193220+
MFCD03817231
ZINC000150473898
ZINC150473898
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.