Vitas-M small molecule compound
3-amino-2-[(3,4-diethoxyphenyl)acetyl]-5,5-dimethylcyclohex-2-en-1-one
Catalog ID
STK682303
SMILES CCOc1cc(ccc1OCC)CC(=O)C1=C(N)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 C20H27NO4 MW 345.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H27NO4/c1-5-24-17-8-7-13(10-18(17)25-6-2)9-15(22)19-14(21)11-20(3,4)12-16(19)23/h7-8,10H,5-6,9,11-12,21H2,1-4H3InChIKey
PAFQWQACOGFKHS-UHFFFAOYSA-NSynonyms
3amino2((34diethoxyphenyl)acetyl)55dimethylcyclohex2en1one
3AMINO2(2(34DIETHOXYPHENYL)ACETYL)55DIMETHYLCYCLOHEX2EN1ONE
CCOC1=C(C=C(C=C1)CC(=O)C2=C(CC(CC2=O)(C)C)N)OCC
CYCLOHEX2ENONE3AMINO2(2(34DIETHOXYPHENYL)ACETYL)55DIMETHYL
InChI=1SC20H27NO4c1524178713(1018(17)2562)915(22)1914(21)1120(34)1216(19)23h7810H569111221H214H3
MFCD03855263
ZINC000100147518
ZINC100147518
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