Vitas-M small molecule compound
methyl 4-{4-[(cyclopropylcarbonyl)oxy]-3-ethoxyphenyl}-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK363513
SMILES CCOc1cc(ccc1OC(=O)C1CC1)C1C(=C(C)NC2=C1C(=O)CC(C2)(C)C)C(=O)OC
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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 C26H31NO6 MW 453.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H31NO6/c1-6-32-20-11-16(9-10-19(20)33-24(29)15-7-8-15)22-21(25(30)31-5)14(2)27-17-12-26(3,4)13-18(28)23(17)22/h9-11,15,22,27H,6-8,12-13H2,1-5H3InChIKey
KGSGCLIBQQGAQD-UHFFFAOYSA-NSynonyms
306749-38-2306749382
CCOC1=C(C=CC(=C1)C2C3=C(CC(CC3=O)(C)C)NC(=C2C(=O)OC)C)OC(=O)C4CC4
InChI=1SC26H31NO6c1632201116(91019(20)3324(29)157815)2221(25(30)315)14(2)27171226(34)1318(28)23(17)22h911152227H681213H215H3
methyl4(4((cyclopropylcarbonyl)oxy)3ethoxyphenyl)277trimethyl5oxo145678hexahydroquinoline3carboxylate
methyl4(4(cyclopropanecarbonyloxy)3ethoxyphenyl)277trimethyl5oxo1468tetrahydroquinoline3carboxylate
MFCD01445549
ZINC000000707615
ZINC000004067476
Check stock
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Check stock on Vitas-MAvailable files
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