Vitas-M small molecule compound

methyl 3-{3-methoxy-4-[(2-methylprop-2-en-1-yl)oxy]phenyl}-3-(5,6,7-trihydroxy-4-oxo-2-phenyl-4H-chromen-8-yl)propanoate

Catalog ID
STL540956
SMILES COC(=O)CC(c1c(O)c(O)c(c2c1oc(cc2=O)c1ccccc1)O)c1ccc(c(c1)OC)OCC(=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 C30H28O9 MW 532.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H28O9/c1-16(2)15-38-21-11-10-18(12-23(21)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,1,13,15H2,2-4H3
InChIKey
OOILVXIFJPWHBA-UHFFFAOYSA-N
Synonyms
1574352-76-3
1574352763
75492393
InChI=1SC30H28O9c116(2)153821111018(1223(21)363)19(1324(32)374)2527(33)29(35)28(34)2620(31)1422(3930(25)26)178657917h51214193335H11315H224H3
METHYL3(3METHOXY4((2METHYLALLYL)OXY)PHENYL)3(567TRIHYDROXY4OXO2PHENYL4HCHROMEN8YL)PROPANOATE
methyl3(3methoxy4((2methylprop2en1yl)oxy)phenyl)3(567trihydroxy4oxo2phenyl4Hchromen8yl)propanoate
methyl3(3methoxy4(2methylprop2enoxy)phenyl)3(567trihydroxy4oxo2phenylchromen8yl)propanoate
MFCD28052662
ZINC000108451032
ZINC000108451036

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Available files

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