Vitas-M small molecule compound
tetrahydrofuran-2-ylmethyl 4-(3-bromo-5-ethoxy-4-hydroxyphenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK051296
SMILES CCOc1cc(cc(c1O)Br)C1C(=C(C)NC2=C1C(=O)CCC2)C(=O)OCC1CCCO1
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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 C24H28BrNO6 MW 506.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H28BrNO6/c1-3-30-19-11-14(10-16(25)23(19)28)21-20(24(29)32-12-15-6-5-9-31-15)13(2)26-17-7-4-8-18(27)22(17)21/h10-11,15,21,26,28H,3-9,12H2,1-2H3InChIKey
MVJJOQINSDLWDI-UHFFFAOYSA-NSynonyms
CCOC1=C(C(=CC(=C1)C2C3=C(CCCC3=O)NC(=C2C(=O)OCC4CCCO4)C)Br)O
CCOc1cc(cc(c1O)Br)C1C(=C(C)NC2=C1C(=O)CCC2)C(=O)OCC1CCCO1
InChI=1SC24H28BrNO6c1330191114(1016(25)23(19)28)2120(24(29)3212156593115)13(2)261774818(27)22(17)21h101115212628H3912H212H3
MFCD01528052
oxolan2ylmethyl4(3bromo5ethoxy4hydroxyphenyl)2methyl5oxo4678tetrahydro1Hquinoline3carboxylate
STK051296
tetrahydrofuran2ylmethyl4(3bromo5ethoxy4hydroxyphenyl)2methyl5oxo145678hexahydroquinoline3carboxylate
ZINC000004068213
ZINC000004068216
ZINC04068216
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