Vitas-M small molecule compound
3-{4,8-dimethyl-7-[(2-methylbenzyl)oxy]-2-oxo-2H-chromen-3-yl}propanoic acid
Catalog ID
STL463271
SMILES OC(=O)CCc1c(=O)oc2c(c1C)ccc(c2C)OCc1ccccc1C
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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 C22H22O5 MW 366.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22O5/c1-13-6-4-5-7-16(13)12-26-19-10-8-17-14(2)18(9-11-20(23)24)22(25)27-21(17)15(19)3/h4-8,10H,9,11-12H2,1-3H3,(H,23,24)InChIKey
DOSYRRRGZXQYIO-UHFFFAOYSA-NSynonyms
858747-53-23(48dimethyl7((2methylbenzyl)oxy)2oxo2Hchromen3yl)propanoicacid
3(48DIMETHYL7((2METHYLPHENYL)METHOXY)2OXOCHROMEN3YL)PROPANOICACID
858747532
CC1=CC=CC=C1COC2=C(C3=C(C=C2)C(=C(C(=O)O3)CCC(=O)O)C)C
InChI=1SC22H22O5c113645716(13)1226191081714(2)18(91120(23)24)22(25)2721(17)15(19)3h4810H91112H213H3(H2324)
MFCD03851731
ZINC000002150027
ZINC2150027
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