Vitas-M small molecule compound
methyl 3-{4-methoxy-3-[(2-methylprop-2-en-1-yl)oxy]phenyl}-3-(5,6,7-trihydroxy-4-oxo-2-phenyl-4H-chromen-8-yl)propanoate
Catalog ID
STL542231
SMILES COC(=O)CC(c1c(O)c(O)c(c2c1oc(cc2=O)c1ccccc1)O)c1ccc(c(c1)OCC(=C)C)OC
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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 C30H28O9 MW 532.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H28O9/c1-16(2)15-38-23-12-18(10-11-21(23)36-3)19(13-24(32)37-4)25-27(33)29(35)28(34)26-20(31)14-22(39-30(25)26)17-8-6-5-7-9-17/h5-12,14,19,33-35H,1,13,15H2,2-4H3InChIKey
HGQPXDPYODWARJ-UHFFFAOYSA-NSynonyms
1574353-44-81574353448
75492530
InChI=1SC30H28O9c116(2)1538231218(101121(23)363)19(1324(32)374)2527(33)29(35)28(34)2620(31)1422(3930(25)26)178657917h51214193335H11315H224H3
METHYL3(4METHOXY3((2METHYLALLYL)OXY)PHENYL)3(567TRIHYDROXY4OXO2PHENYL4HCHROMEN8YL)PROPANOATE
methyl3(4methoxy3((2methylprop2en1yl)oxy)phenyl)3(567trihydroxy4oxo2phenyl4Hchromen8yl)propanoate
methyl3(4methoxy3(2methylprop2enoxy)phenyl)3(567trihydroxy4oxo2phenylchromen8yl)propanoate
MFCD28052717
ZINC000108451408
ZINC000108451410
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