Vitas-M small molecule compound
cyclohexyl 4-(4-ethoxy-3-methoxyphenyl)-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK372339
SMILES CCOc1ccc(cc1OC)C1C(=C(C)NC2=C1C(=O)CC(C2)(C)C)C(=O)OC1CCCCC1
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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 C28H37NO5 MW 467.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H37NO5/c1-6-33-22-13-12-18(14-23(22)32-5)25-24(27(31)34-19-10-8-7-9-11-19)17(2)29-20-15-28(3,4)16-21(30)26(20)25/h12-14,19,25,29H,6-11,15-16H2,1-5H3InChIKey
NBCVWDVLUGFACI-UHFFFAOYSA-NSynonyms
CCOC1=C(C=C(C=C1)C2C3=C(CC(CC3=O)(C)C)NC(=C2C(=O)OC4CCCCC4)C)OC
cyclohexyl4(4ethoxy3methoxyphenyl)277trimethyl5oxo145678hexahydroquinoline3carboxylate
cyclohexyl4(4ethoxy3methoxyphenyl)277trimethyl5oxo1468tetrahydroquinoline3carboxylate
InChI=1SC28H37NO5c163322131218(1423(22)325)2524(27(31)3419108791119)17(2)29201528(34)1621(30)26(20)25h1214192529H6111516H215H3
MFCD00753387
ZINC000000726684
ZINC000000726685
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Check stock on Vitas-MAvailable files
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