Vitas-M small molecule compound
cyclohexyl 4-(4-methoxyphenyl)-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK002723
SMILES COc1ccc(cc1)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 C26H33NO4 MW 423.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H33NO4/c1-16-22(25(29)31-19-8-6-5-7-9-19)23(17-10-12-18(30-4)13-11-17)24-20(27-16)14-26(2,3)15-21(24)28/h10-13,19,23,27H,5-9,14-15H2,1-4H3InChIKey
PIGUGUNPRRTJGI-UHFFFAOYSA-NSynonyms
299451-14-2299451142
CC1=C(C(C2=C(N1)CC(CC2=O)(C)C)C3=CC=C(C=C3)OC)C(=O)OC4CCCCC4
COc1ccc(cc1)C1C(=C(C)NC2=C1C(=O)CC(C2)(C)C)C(=O)OC1CCCCC1
cyclohexyl4(4methoxyphenyl)277trimethyl5oxo145678hexahydroquinoline3carboxylate
cyclohexyl4(4methoxyphenyl)277trimethyl5oxo1468tetrahydroquinoline3carboxylate
InChI=1SC26H33NO4c11622(25(29)31198657919)23(17101218(304)131117)2420(2716)1426(23)1521(24)28h1013192327H591415H214H3
MFCD00770998
STK002723
ZINC000000626742
ZINC000000626746
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