Vitas-M small molecule compound
cyclopentyl 4-(2-ethoxyphenyl)-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK038334
SMILES CCOc1ccccc1C1C(=C(C)NC2=C1C(=O)CC(C2)(C)C)C(=O)OC1CCCC1
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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 C26H33NO4 MW 423.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H33NO4/c1-5-30-21-13-9-8-12-18(21)23-22(25(29)31-17-10-6-7-11-17)16(2)27-19-14-26(3,4)15-20(28)24(19)23/h8-9,12-13,17,23,27H,5-7,10-11,14-15H2,1-4H3InChIKey
QMNSLIAWJHUJJV-UHFFFAOYSA-NSynonyms
CCOC1=CC=CC=C1C2C3=C(CC(CC3=O)(C)C)NC(=C2C(=O)OC4CCCC4)C
CCOc1ccccc1C1C(=C(C)NC2=C1C(=O)CC(C2)(C)C)C(=O)OC1CCCC1
cyclopentyl4(2ethoxyphenyl)277trimethyl5oxo145678hexahydroquinoline3carboxylate
cyclopentyl4(2ethoxyphenyl)277trimethyl5oxo1468tetrahydroquinoline3carboxylate
InChI=1SC26H33NO4c15302113981218(21)2322(25(29)311710671117)16(2)27191426(34)1520(28)24(19)23h891213172327H5710111415H214H3
MFCD00631903
STK038334
ZINC000000848132
ZINC000000848133
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