Vitas-M small molecule compound
3-[5-methyl-3-(4-methylphenyl)-7-oxo-7H-furo[3,2-g]chromen-6-yl]propanoic acid
Catalog ID
STL456856
SMILES OC(=O)CCc1c(=O)oc2c(c1C)cc1c(c2)occ1c1ccc(cc1)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 C22H18O5 MW 362.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H18O5/c1-12-3-5-14(6-4-12)18-11-26-19-10-20-16(9-17(18)19)13(2)15(22(25)27-20)7-8-21(23)24/h3-6,9-11H,7-8H2,1-2H3,(H,23,24)InChIKey
IVPSOCGTIIFJDC-UHFFFAOYSA-NSynonyms
853892-65-63(5methyl3(4methylphenyl)7oxo7Hfuro(32g)chromen6yl)propanoicacid
3(5METHYL3(4METHYLPHENYL)7OXOFURO(32G)CHROMEN6YL)PROPANOICACID
3(5methyl7oxo3(ptolyl)7Hfuro(32g)chromen6yl)propanoicacid
853892656
CC1=CC=C(C=C1)C2=COC3=CC4=C(C=C32)C(=C(C(=O)O4)CCC(=O)O)C
InChI=1SC22H18O5c1123514(6412)18112619102016(917(18)19)13(2)15(22(25)2720)7821(23)24h36911H78H212H3(H2324)
MFCD05674846
ZINC000002120343
ZINC2120343
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