Vitas-M small molecule compound
propan-2-yl 2,7,7-trimethyl-5-oxo-4-(2,3,4-trimethoxyphenyl)-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK079280
SMILES COc1ccc(c(c1OC)OC)C1C(=C(C)NC2=C1C(=O)CC(C2)(C)C)C(=O)OC(C)C
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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 C25H33NO6 MW 443.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H33NO6/c1-13(2)32-24(28)19-14(3)26-16-11-25(4,5)12-17(27)21(16)20(19)15-9-10-18(29-6)23(31-8)22(15)30-7/h9-10,13,20,26H,11-12H2,1-8H3InChIKey
FEZMOVFHKBVVPK-UHFFFAOYSA-NSynonyms
CC1=C(C(C2=C(N1)CC(CC2=O)(C)C)C3=C(C(=C(C=C3)OC)OC)OC)C(=O)OC(C)C
COc1ccc(c(c1OC)OC)C1C(=C(C)NC2=C1C(=O)CC(C2)(C)C)C(=O)OC(C)C
InChI=1SC25H33NO6c113(2)3224(28)1914(3)26161125(45)1217(27)21(16)20(19)1591018(296)23(318)22(15)307h910132026H1112H218H3
MFCD00753119
propan2yl277trimethyl5oxo4(234trimethoxyphenyl)145678hexahydroquinoline3carboxylate
propan2yl277trimethyl5oxo4(234trimethoxyphenyl)1468tetrahydroquinoline3carboxylate
STK079280
ZINC000019638504
ZINC000019638509
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