Vitas-M small molecule compound
2-butanoyl-5-(3,4-dimethoxyphenyl)cyclohexane-1,3-dione
Catalog ID
STK686258
SMILES CCCC(=O)C1C(=O)CC(CC1=O)c1ccc(c(c1)OC)OC
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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 C18H22O5 MW 318.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H22O5/c1-4-5-13(19)18-14(20)8-12(9-15(18)21)11-6-7-16(22-2)17(10-11)23-3/h6-7,10,12,18H,4-5,8-9H2,1-3H3InChIKey
DPVBDQUVCYTBRZ-UHFFFAOYSA-NSynonyms
2butanoyl5(34dimethoxyphenyl)cyclohexane13dione
5(34DIMETHOXYPHENYL)2BUTANOYLCYCLOHEXANE13DIONE
CCCC(=O)C1C(=O)CC(CC1=O)C2=CC(=C(C=C2)OC)OC
InChI=1SC18H22O5c14513(19)1814(20)812(915(18)21)116716(222)17(1011)233h67101218H4589H213H3
MFCD06015443
ZINC000102773130
ZINC102773130
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