Vitas-M small molecule compound
methyl 3-{4-methyl-7-[(4-methylbenzyl)oxy]-2-oxo-2H-chromen-6-yl}propanoate
Catalog ID
STK925247
SMILES COC(=O)CCc1cc2c(C)cc(=O)oc2cc1OCc1ccc(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 C22H22O5 MW 366.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22O5/c1-14-4-6-16(7-5-14)13-26-19-12-20-18(15(2)10-22(24)27-20)11-17(19)8-9-21(23)25-3/h4-7,10-12H,8-9,13H2,1-3H3InChIKey
DOLTXSHSTHPOHY-UHFFFAOYSA-NSynonyms
929490-31-3929490313
CC1=CC=C(C=C1)COC2=C(C=C3C(=CC(=O)OC3=C2)C)CCC(=O)OC
InChI=1SC22H22O5c1144616(7514)132619122018(15(2)1022(24)2720)1117(19)8921(23)253h471012H8913H213H3
methyl3(4methyl7((4methylbenzyl)oxy)2oxo2Hchromen6yl)propanoate
METHYL3(4METHYL7((4METHYLPHENYL)METHOXY)2OXOCHROMEN6YL)PROPANOATE
MFCD10041267
ZINC000011865191
ZINC11865191
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