Vitas-M small molecule compound
methyl 3-(3-hydroxy-1,4-dioxo-1,4-dihydronaphthalen-2-yl)-3-[4-(propan-2-yloxy)phenyl]propanoate
Catalog ID
STL542793
SMILES COC(=O)CC(C1=C(O)C(=O)c2c(C1=O)cccc2)c1ccc(cc1)OC(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 C23H22O6 MW 394.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H22O6/c1-13(2)29-15-10-8-14(9-11-15)18(12-19(24)28-3)20-21(25)16-6-4-5-7-17(16)22(26)23(20)27/h4-11,13,18,27H,12H2,1-3H3InChIKey
NIVWQTUPEDHCJD-UHFFFAOYSA-NSynonyms
InChI=1SC23H22O6c113(2)291510814(91115)18(1219(24)283)2021(25)16645717(16)22(26)23(20)27h411131827H12H213H3
methyl3(3hydroxy14dioxo14dihydronaphthalen2yl)3(4(propan2yloxy)phenyl)propanoate
methyl3(3hydroxy14dioxo14dihydronaphthalen2yl)3(4isopropoxyphenyl)propanoate
MFCD28349953
ZINC000217883719
ZINC000217883792
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