Vitas-M small molecule compound
4-{1-[2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxy-4-oxo-4H-chromen-8-yl]-3-methoxy-3-oxopropyl}benzoic acid
Catalog ID
STL540231
SMILES COC(=O)CC(c1c(O)cc(c2c1oc(c1ccc(c(c1)O)O)c(c2=O)O)O)c1ccc(cc1)C(=O)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 C26H20O11 MW 508.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H20O11/c1-36-19(31)9-14(11-2-4-12(5-3-11)26(34)35)20-17(29)10-18(30)21-22(32)23(33)24(37-25(20)21)13-6-7-15(27)16(28)8-13/h2-8,10,14,27-30,33H,9H2,1H3,(H,34,35)InChIKey
NNBSREFUYWJURU-UHFFFAOYSA-NSynonyms
1574480-48-01574480480
4(1(2(34dihydroxyphenyl)357trihydroxy4oxo4Hchromen8yl)3methoxy3oxopropyl)benzoicacid
4(1(2(34dihydroxyphenyl)357trihydroxy4oxochromen8yl)3methoxy3oxopropyl)benzoicacid
71827160
InChI=1SC26H20O11c13619(31)914(112412(5311)26(34)35)2017(29)1018(30)2122(32)23(33)24(3725(20)21)136715(27)16(28)813h281014273033H9H21H3(H3435)
MFCD28050773
ZINC000096114091
ZINC000096114092
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