Vitas-M small molecule compound

3,3'-[2-(3,4-dichlorophenyl)propane-1,3-diyl]bis(4-hydroxy-6-methyl-2H-pyran-2-one)

Catalog ID
STK987636
SMILES Cc1cc(O)c(c(=O)o1)CC(c1ccc(c(c1)Cl)Cl)Cc1c(O)cc(oc1=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 C21H18Cl2O6 MW 437.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18Cl2O6/c1-10-5-18(24)14(20(26)28-10)7-13(12-3-4-16(22)17(23)9-12)8-15-19(25)6-11(2)29-21(15)27/h3-6,9,13,24-25H,7-8H2,1-2H3
InChIKey
BDULVGZZFNQLJC-UHFFFAOYSA-N
Synonyms
3(2(34dichlorophenyl)3(4hydroxy6methyl2oxopyran3yl)propyl)4hydroxy6methylpyran2one
33(2(34dichlorophenyl)propane13diyl)bis(4hydroxy6methyl2Hpyran2one)
CC1=CC(=C(C(=O)O1)CC(CC2=C(C=C(OC2=O)C)O)C3=CC(=C(C=C3)Cl)Cl)O
Registry IDs
MFCD06650333
ZINC000016756402
ZINC16756402

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Available files

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