Vitas-M small molecule compound
(8Z,8'Z)-1,1',6,6'-tetrahydroxy-3,3'-dimethyl-5,5'-di(propan-2-yl)-8,8'-bis[(pyridin-3-ylamino)methylidene]-2,2'-binaphthalene-7,7'(8H,8'H)-dione
Catalog ID
STL513597
SMILES CC(C1=C(O)C(=O)/C(=C\Nc2cccnc2)/c2c1cc(C)c(c2O)c1c(C)cc2c(c1O)/C(=C/Nc1cccnc1)/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 C40H38N4O6 MW 670.77 g/mol Purity >90% as per NMR
InChI
InChI=1S/C40H38N4O6/c1-19(2)29-25-13-21(5)31(37(47)33(25)27(35(45)39(29)49)17-43-23-9-7-11-41-15-23)32-22(6)14-26-30(20(3)4)40(50)36(46)28(34(26)38(32)48)18-44-24-10-8-12-42-16-24/h7-20,43-44,47-50H,1-6H3/b27-17-,28-18-InChIKey
ITNHUUOKXSRBTQ-HJTNQMAYSA-NSynonyms
213019-56-8(1~(Z))7((8~(Z))16dihydroxy3methyl7oxo5propan2yl8((pyridin3ylamino)methylidene)naphthalen2yl)38dihydroxy6methyl4propan2yl1((pyridin3ylamino)methylidene)naphthalen2one
(8Z8Z)1166tetrahydroxy33dimethyl55di(propan2yl)88bis((pyridin3ylamino)methylidene)22binaphthalene77(8H8H)dione
(8Z8Z)1166tetrahydroxy55diisopropyl33dimethyl88bis((pyridin3ylamino)methylene)(22binaphthalene)77(8H8H)dione
10675954
213019568
CC(C1=C(O)C(=O)C(=CNc2cccnc2)c2c1cc(C)c(c2O)c1c(C)cc2c(c1O)C(=CNc1cccnc1)C(=O)C(=C2C(C)C)O)C
InChI=1SC40H38N4O6c119(2)29251321(5)31(37(47)33(25)27(35(45)39(29)49)1743239711411523)3222(6)142630(20(3)4)40(50)36(46)28(34(26)38(32)48)18442410812421624h72043444750H16H3b27172818
MFCD01084125
ZINC000150349513
ZINC150349513
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.