Vitas-M small molecule compound

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

Catalog ID
STK987641
SMILES COc1cc(ccc1O)C(Cc1c(O)cc(oc1=O)C)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 C22H22O8 MW 414.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22O8/c1-11-6-18(24)15(21(26)29-11)8-14(13-4-5-17(23)20(10-13)28-3)9-16-19(25)7-12(2)30-22(16)27/h4-7,10,14,23-25H,8-9H2,1-3H3
InChIKey
JFKPXGXRRGGJCO-UHFFFAOYSA-N
Synonyms

33(2(4hydroxy3methoxyphenyl)propane13diyl)bis(4hydroxy6methyl2Hpyran2one)
4hydroxy3(2(4hydroxy3methoxyphenyl)3(4hydroxy6methyl2oxopyran3yl)propyl)6methylpyran2one
CC1=CC(=C(C(=O)O1)CC(CC2=C(C=C(OC2=O)C)O)C3=CC(=C(C=C3)O)OC)O
InChI=1SC22H22O8c111618(24)15(21(26)2911)814(134517(23)20(1013)283)91619(25)712(2)3022(16)27h4710142325H89H213H3
MFCD06650341
ZINC000016756424
ZINC16756424

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.