Vitas-M small molecule compound
4-[bis(2-hydroxy-4,4-dimethyl-6-oxocyclohex-1-en-1-yl)methyl]-2-methoxyphenyl 3-methoxybenzoate
Catalog ID
STK150148
SMILES COc1cccc(c1)C(=O)Oc1ccc(cc1OC)C(C1=C(O)CC(CC1=O)(C)C)C1=C(O)CC(CC1=O)(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 C32H36O8 MW 548.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H36O8/c1-31(2)14-21(33)28(22(34)15-31)27(29-23(35)16-32(3,4)17-24(29)36)18-10-11-25(26(13-18)39-6)40-30(37)19-8-7-9-20(12-19)38-5/h7-13,27,33,35H,14-17H2,1-6H3InChIKey
JQDOZUGRIBGODU-UHFFFAOYSA-NSynonyms
(4(BIS(2HYDROXY44DIMETHYL6OXOCYCLOHEXEN1YL)METHYL)2METHOXYPHENYL)3METHOXYBENZOATE
4(BIS(2HYDROXY44DIMETHYL6OXOCYCLOHEX1EN1YL)METHYL)2METHOXYPHENYL3METHOXYBENZOATE
CC1(CC(=C(C(=O)C1)C(C2=CC(=C(C=C2)OC(=O)C3=CC(=CC=C3)OC)OC)C4=C(CC(CC4=O)(C)C)O)O)C
InChI=1SC32H36O8c131(2)1421(33)28(22(34)1531)27(2923(35)1632(34)1724(29)36)18101125(26(1318)396)4030(37)1987920(1219)385h713273335H1417H216H3
MFCD03827589
ZINC000100820545
ZINC100820545
Check stock
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