Vitas-M small molecule compound
methyl 3-(3-{[4-(propan-2-yl)benzyl]oxy}phenyl)-3-(5,6,7-trihydroxy-4-oxo-2-phenyl-4H-chromen-8-yl)propanoate
Catalog ID
STL545295
SMILES COC(=O)CC(c1c(O)c(O)c(c2c1oc(cc2=O)c1ccccc1)O)c1cccc(c1)OCc1ccc(cc1)C(C)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 C35H32O8 MW 580.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C35H32O8/c1-20(2)22-14-12-21(13-15-22)19-42-25-11-7-10-24(16-25)26(17-29(37)41-3)30-32(38)34(40)33(39)31-27(36)18-28(43-35(30)31)23-8-5-4-6-9-23/h4-16,18,20,26,38-40H,17,19H2,1-3H3InChIKey
JRTWIOJTCRAXDT-UHFFFAOYSA-NSynonyms
1574354-31-61574354316
75491548
InChI=1SC35H32O8c120(2)22141221(131522)1942251171024(1625)26(1729(37)413)3032(38)34(40)33(39)3127(36)1828(4335(30)31)238546923h4161820263840H1719H213H3
methyl3(3((4(propan2yl)benzyl)oxy)phenyl)3(567trihydroxy4oxo2phenyl4Hchromen8yl)propanoate
METHYL3(3((4ISOPROPYLBENZYL)OXY)PHENYL)3(567TRIHYDROXY4OXO2PHENYL4HCHROMEN8YL)PROPANOATE
methyl3(3((4propan2ylphenyl)methoxy)phenyl)3(567trihydroxy4oxo2phenylchromen8yl)propanoate
MFCD28052336
ZINC000108448915
ZINC000108448918
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