Vitas-M small molecule compound
3-cyclohexyl 6-methyl 4-(3-ethoxy-4-hydroxyphenyl)-2,7-dimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3,6-dicarboxylate
Catalog ID
STK405042
SMILES CCOc1cc(ccc1O)C1C(=C(C)NC2=C1C(=O)C(C(C2)C)C(=O)OC)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 C28H35NO7 MW 497.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H35NO7/c1-5-35-21-14-17(11-12-20(21)30)24-23(28(33)36-18-9-7-6-8-10-18)16(3)29-19-13-15(2)22(27(32)34-4)26(31)25(19)24/h11-12,14-15,18,22,24,29-30H,5-10,13H2,1-4H3InChIKey
XVPRMBMIFSKYIR-UHFFFAOYSA-NSynonyms
3cyclohexyl6methyl4(3ethoxy4hydroxyphenyl)27dimethyl5oxo145678hexahydroquinoline36dicarboxylate
3Ocyclohexyl6Omethyl4(3ethoxy4hydroxyphenyl)27dimethyl5oxo4678tetrahydro1Hquinoline36dicarboxylate
CCOC1=C(C=CC(=C1)C2C3=C(CC(C(C3=O)C(=O)OC)C)NC(=C2C(=O)OC4CCCCC4)C)O
InChI=1SC28H35NO7c1535211417(111220(21)30)2423(28(33)361897681018)16(3)29191315(2)22(27(32)344)26(31)25(19)24h111214151822242930H51013H214H3
MFCD06194108
ZINC000004789013
ZINC000102558602
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