Vitas-M small molecule compound
4-[(1-{[(3-carboxypropanoyl)oxy]methyl}-1,4a-dimethyl-6-methylidene-5-[(E)-2-(2-oxo-2,5-dihydrofuran-3-yl)ethenyl]decahydronaphthalen-2-yl)oxy]-4-oxobutanoate
Catalog ID
STL005240
SMILES [O-]C(=O)CCC(=O)OC1CCC2(C(C1(C)COC(=O)CCC(=O)O)CCC(=C)C2/C=C/C1=CCOC1=O)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 C28H35O10 MW 531.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H36O10/c1-17-4-7-20-27(2,19(17)6-5-18-13-15-36-26(18)35)14-12-21(38-25(34)11-9-23(31)32)28(20,3)16-37-24(33)10-8-22(29)30/h5-6,13,19-21H,1,4,7-12,14-16H2,2-3H3,(H,29,30)(H,31,32)/p-1/b6-5+InChIKey
YTHKMAIVPFVDNU-AATRIKPKSA-MSynonyms
76958-99-1(O)C(=O)CCC(=O)OC1CCC2(C(C1(C)COC(=O)CCC(=O)O)CCC(=C)C2C=CC1=CCOC1=O)C
4((1(((3carboxypropanoyl)oxy)methyl)14adimethyl6methylidene5((E)2(2oxo25dihydrofuran3yl)ethenyl)decahydronaphthalen2yl)oxy)4oxobutanoate
4((1(3carboxypropanoyloxymethyl)14adimethyl6methylidene5((E)2(5oxo2Hfuran4yl)ethenyl)345788ahexahydro2Hnaphthalen2yl)oxy)4oxobutanoate
76958991
CC12CCC(C(C1CCC(=C)C2C=CC3=CCOC3=O)(C)COC(=O)CCC(=O)O)OC(=O)CCC(=O)(O)
InChI=1SC28H36O10c117472027(219(17)651813153626(18)35)141221(3825(34)11923(31)32)28(203)163724(33)10822(29)30h56131921H147121416H223H3(H2930)(H3132)p1b65+
Check stock
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Check stock on Vitas-MAvailable files
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