Vitas-M small molecule compound
2-[(2-ethoxyphenyl)(2-hydroxy-4,4-dimethyl-6-oxocyclohex-1-en-1-yl)methyl]-5,5-dimethylcyclohexane-1,3-dione
Catalog ID
STK044697
SMILES CCOc1ccccc1C(C1=C(O)CC(CC1=O)(C)C)C1C(=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 C25H32O5 MW 412.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H32O5/c1-6-30-20-10-8-7-9-15(20)21(22-16(26)11-24(2,3)12-17(22)27)23-18(28)13-25(4,5)14-19(23)29/h7-10,21-22,28H,6,11-14H2,1-5H3InChIKey
HCOCLHZRLORMND-UHFFFAOYSA-NSynonyms
5315-19-52((2ETHOXYPHENYL)(2HYDROXY44DIMETHYL6OXO1CYCLOHEXEN1YL)METHYL)55DIMETHYL13CYCLOHEXANEDIONE
2((2ETHOXYPHENYL)(2HYDROXY44DIMETHYL6OXOCYCLOHEX1EN1YL)METHYL)55DIMETHYLCYCLOHEXANE13DIONE
2((2ETHOXYPHENYL)(2HYDROXY44DIMETHYL6OXOCYCLOHEXEN1YL)METHYL)55DIMETHYLCYCLOHEXANE13DIONE
2((2ETHOXYPHENYL)(6HYDROXY44DIMETHYL2OXOCYCLOHEX1(6)ENYL)METHYL)55DIMETHYLCYCLOHEXANE13DIONE
5315195
CCOC1=CC=CC=C1C(C2C(=O)CC(CC2=O)(C)C)C3=C(CC(CC3=O)(C)C)O
CCOc1ccccc1C(C1=C(O)CC(CC1=O)(C)C)C1C(=O)CC(CC1=O)(C)C
InChI=1SC25H32O5c1630201087915(20)21(2216(26)1124(23)1217(22)27)2318(28)1325(45)1419(23)29h710212228H61114H215H3
MFCD01030127
STK044697
ZINC000100003774
ZINC000100003776
Check stock
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Check stock on Vitas-MAvailable files
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