Vitas-M small molecule compound

methyl 3-[2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxy-4-oxo-4H-chromen-8-yl]-3-[1-(propan-2-yl)-1H-pyrazol-4-yl]propanoate

Catalog ID
STL541109
SMILES COC(=O)CC(c1c(O)cc(c2c1oc(c1ccc(c(c1)O)O)c(c2=O)O)O)c1cnn(c1)C(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 C25H24N2O9 MW 496.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H24N2O9/c1-11(2)27-10-13(9-26-27)14(7-19(32)35-3)20-17(30)8-18(31)21-22(33)23(34)24(36-25(20)21)12-4-5-15(28)16(29)6-12/h4-6,8-11,14,28-31,34H,7H2,1-3H3
InChIKey
AOSOYEDHNIHJED-UHFFFAOYSA-N
Synonyms
1574480-37-7
1574480377
71827213
InChI=1SC25H24N2O9c111(2)271013(92627)14(719(32)353)2017(30)818(31)2122(33)23(34)24(3625(20)21)124515(28)16(29)612h4681114283134H7H213H3
methyl3(2(34dihydroxyphenyl)357trihydroxy4oxo4Hchromen8yl)3(1(propan2yl)1Hpyrazol4yl)propanoate
METHYL3(2(34DIHYDROXYPHENYL)357TRIHYDROXY4OXO4HCHROMEN8YL)3(1ISOPROPYL1HPYRAZOL4YL)PROPANOATE
methyl3(2(34dihydroxyphenyl)357trihydroxy4oxochromen8yl)3(1propan2ylpyrazol4yl)propanoate
MFCD28050729
ZINC000096114012
ZINC000096114013

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Available files

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