Vitas-M small molecule compound
methyl 3-[4-(prop-2-yn-1-yloxy)phenyl]-3-(5,6,7-trihydroxy-4-oxo-2-phenyl-4H-chromen-8-yl)propanoate
Catalog ID
STL543730
SMILES C#CCOc1ccc(cc1)C(c1c(O)c(O)c(c2c1oc(cc2=O)c1ccccc1)O)CC(=O)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 C28H22O8 MW 486.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H22O8/c1-3-13-35-18-11-9-16(10-12-18)19(14-22(30)34-2)23-25(31)27(33)26(32)24-20(29)15-21(36-28(23)24)17-7-5-4-6-8-17/h1,4-12,15,19,31-33H,13-14H2,2H3InChIKey
LPTMFBQHYZMNMQ-UHFFFAOYSA-NSynonyms
1574293-08-51574293085
75492492
InChI=1SC28H22O8c1313351811916(101218)19(1422(30)342)2325(31)27(33)26(32)2420(29)1521(3628(23)24)177546817h141215193133H1314H22H3
methyl3(4(prop2yn1yloxy)phenyl)3(567trihydroxy4oxo2phenyl4Hchromen8yl)propanoate
methyl3(4prop2ynoxyphenyl)3(567trihydroxy4oxo2phenylchromen8yl)propanoate
MFCD28052700
ZINC000096222805
ZINC000096222807
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