Vitas-M small molecule compound

3,7-bis(methoxycarbonyl)-2,6-dioxobicyclo[3.3.1]nonane-1,5-dicarboxylic acid

Catalog ID
STL552638
SMILES COC(=O)C1CC2(CC(C1=O)(CC(C2=O)C(=O)OC)C(=O)O)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 C15H16O10 MW 356.29 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H16O10/c1-24-10(18)6-3-14(12(20)21)5-15(8(6)16,13(22)23)4-7(9(14)17)11(19)25-2/h6-7H,3-5H2,1-2H3,(H,20,21)(H,22,23)
InChIKey
DKSRMIFOBMGLIQ-UHFFFAOYSA-N
Synonyms
1212437-07-4
(1R3S5R)37BIS(METHOXYCARBONYL)26DIOXOBICYCLO(331)NONANE15DICARBOXYLICACID
(1R3S5R7S)37bis(methoxycarbonyl)26dioxobicyclo(331)nonane15dicarboxylicacid
1212437074
273889
37bis(methoxycarbonyl)26dioxobicyclo(331)nonane15dicarboxylicacid
InChI=1SC15H16O10c12410(18)6314(12(20)21)515(8(6)1613(22)23)47(9(14)17)11(19)252h67H35H212H3(H2021)(H2223)
ZINC000002145683
ZINC000136200517

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.