Vitas-M small molecule compound
methyl 7-(4-ethoxy-3-methoxyphenyl)-2-methyl-5-oxo-4-(3,4,5-trimethoxyphenyl)-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK403472
SMILES CCOc1ccc(cc1OC)C1CC(=O)C2=C(C1)NC(=C(C2c1cc(OC)c(c(c1)OC)OC)C(=O)OC)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 C30H35NO8 MW 537.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H35NO8/c1-8-39-22-10-9-17(13-23(22)34-3)18-11-20-28(21(32)12-18)27(26(16(2)31-20)30(33)38-7)19-14-24(35-4)29(37-6)25(15-19)36-5/h9-10,13-15,18,27,31H,8,11-12H2,1-7H3InChIKey
FLRBCLCBWUVXFU-UHFFFAOYSA-NSynonyms
CCOC1=C(C=C(C=C1)C2CC3=C(C(C(=C(N3)C)C(=O)OC)C4=CC(=C(C(=C4)OC)OC)OC)C(=O)C2)OC
InChI=1SC30H35NO8c18392210917(1323(22)343)18112028(21(32)1218)27(26(16(2)3120)30(33)387)191424(354)29(376)25(1519)365h9101315182731H81112H217H3
methyl7(4ethoxy3methoxyphenyl)2methyl5oxo4(345trimethoxyphenyl)145678hexahydroquinoline3carboxylate
methyl7(4ethoxy3methoxyphenyl)2methyl5oxo4(345trimethoxyphenyl)4678tetrahydro1Hquinoline3carboxylate
MFCD03489319
ZINC000008430410
ZINC000008430419
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