Vitas-M small molecule compound
ethyl 3-{7-[(3-bromobenzyl)oxy]-4,8-dimethyl-2-oxo-2H-chromen-3-yl}propanoate
Catalog ID
STL463316
SMILES CCOC(=O)CCc1c(=O)oc2c(c1C)ccc(c2C)OCc1cccc(c1)Br
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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 C23H23BrO5 MW 459.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H23BrO5/c1-4-27-21(25)11-9-19-14(2)18-8-10-20(15(3)22(18)29-23(19)26)28-13-16-6-5-7-17(24)12-16/h5-8,10,12H,4,9,11,13H2,1-3H3InChIKey
XMABKBLUBABIRK-UHFFFAOYSA-NSynonyms
701280-05-9701280059
CCOC(=O)CCC1=C(C2=C(C(=C(C=C2)OCC3=CC(=CC=C3)Br)C)OC1=O)C
ethyl3(7((3bromobenzyl)oxy)48dimethyl2oxo2Hchromen3yl)propanoate
ETHYL3(7((3BROMOPHENYL)METHOXY)48DIMETHYL2OXOCHROMEN3YL)PROPANOATE
InChI=1SC23H23BrO5c142721(25)1191914(2)1881020(15(3)22(18)2923(19)26)28131665717(24)1216h581012H491113H213H3
MFCD03852943
ZINC000002094083
ZINC02094083
ZINC2094083
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