Vitas-M small molecule compound
methyl 3-(3-chloro-4-hydroxyphenyl)-3-(5,6,7-trihydroxy-4-oxo-2-phenyl-4H-chromen-8-yl)propanoate
Catalog ID
STL541838
SMILES COC(=O)CC(c1c(O)c(O)c(c2c1oc(cc2=O)c1ccccc1)O)c1ccc(c(c1)Cl)O
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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 C25H19ClO8 MW 482.87 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H19ClO8/c1-33-19(29)10-14(13-7-8-16(27)15(26)9-13)20-22(30)24(32)23(31)21-17(28)11-18(34-25(20)21)12-5-3-2-4-6-12/h2-9,11,14,27,30-32H,10H2,1H3InChIKey
BKSMZAZQYIRROT-UHFFFAOYSA-NSynonyms
1574294-60-21574294602
75491413
InChI=1SC25H19ClO8c13319(29)1014(137816(27)15(26)913)2022(30)24(32)23(31)2117(28)1118(3425(20)21)125324612h291114273032H10H21H3
methyl3(3chloro4hydroxyphenyl)3(567trihydroxy4oxo2phenyl4Hchromen8yl)propanoate
methyl3(3chloro4hydroxyphenyl)3(567trihydroxy4oxo2phenylchromen8yl)propanoate
MFCD28052289
ZINC000096221385
ZINC000096221387
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