Vitas-M small molecule compound
cyclopentyl 2,7,7-trimethyl-5-oxo-4-(2-propoxyphenyl)-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK372313
SMILES CCCOc1ccccc1C1C(=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 C27H35NO4 MW 437.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H35NO4/c1-5-14-31-22-13-9-8-12-19(22)24-23(26(30)32-18-10-6-7-11-18)17(2)28-20-15-27(3,4)16-21(29)25(20)24/h8-9,12-13,18,24,28H,5-7,10-11,14-16H2,1-4H3InChIKey
XZEHBYKROOPHBY-UHFFFAOYSA-NSynonyms
CCCOC1=CC=CC=C1C2C3=C(CC(CC3=O)(C)C)NC(=C2C(=O)OC4CCCC4)C
cyclopentyl277trimethyl5oxo4(2propoxyphenyl)145678hexahydroquinoline3carboxylate
cyclopentyl277trimethyl5oxo4(2propoxyphenyl)1468tetrahydroquinoline3carboxylate
InChI=1SC27H35NO4c1514312213981219(22)2423(26(30)321810671118)17(2)28201527(34)1621(29)25(20)24h891213182428H5710111416H214H3
MFCD00753214
ZINC000004061087
ZINC000004061090
Check stock
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Check stock on Vitas-MAvailable files
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