Vitas-M small molecule compound
tetrahydrofuran-2-ylmethyl 4-(2,4-dimethoxyphenyl)-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK023916
SMILES COc1ccc(c(c1)OC)C1C(=C(C)NC2=C1C(=O)CC(C2)(C)C)C(=O)OCC1CCCO1
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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 C26H33NO6 MW 455.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H33NO6/c1-15-22(25(29)33-14-17-7-6-10-32-17)23(18-9-8-16(30-4)11-21(18)31-5)24-19(27-15)12-26(2,3)13-20(24)28/h8-9,11,17,23,27H,6-7,10,12-14H2,1-5H3InChIKey
LJLOULDGCZDEBN-UHFFFAOYSA-NSynonyms
CC1=C(C(C2=C(N1)CC(CC2=O)(C)C)C3=C(C=C(C=C3)OC)OC)C(=O)OCC4CCCO4
COc1ccc(c(c1)OC)C1C(=C(C)NC2=C1C(=O)CC(C2)(C)C)C(=O)OCC1CCCO1
InChI=1SC26H33NO6c11522(25(29)33141776103217)23(189816(304)1121(18)315)2419(2715)1226(23)1320(24)28h8911172327H67101214H215H3
MFCD02632931
oxolan2ylmethyl4(24dimethoxyphenyl)277trimethyl5oxo1468tetrahydroquinoline3carboxylate
STK023916
tetrahydrofuran2ylmethyl4(24dimethoxyphenyl)277trimethyl5oxo145678hexahydroquinoline3carboxylate
ZINC000020058003
ZINC000020058006
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