Vitas-M small molecule compound
3-(2-ethoxyethyl) 6-methyl 2,7-dimethyl-5-oxo-4-(4-oxo-4H-chromen-3-yl)-1,4,5,6,7,8-hexahydroquinoline-3,6-dicarboxylate
Catalog ID
STK404631
SMILES CCOCCOC(=O)C1=C(C)NC2=C(C1c1coc3c(c1=O)cccc3)C(=O)C(C(C2)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 C27H29NO8 MW 495.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H29NO8/c1-5-34-10-11-35-27(32)21-15(3)28-18-12-14(2)20(26(31)33-4)25(30)23(18)22(21)17-13-36-19-9-7-6-8-16(19)24(17)29/h6-9,13-14,20,22,28H,5,10-12H2,1-4H3InChIKey
FDBWGZRAOYDOBP-UHFFFAOYSA-NSynonyms
3(2ethoxyethyl)6methyl27dimethyl5oxo4(4oxo4Hchromen3yl)145678hexahydroquinoline36dicarboxylate
3O(2ethoxyethyl)6Omethyl27dimethyl5oxo4(4oxochromen3yl)4678tetrahydro1Hquinoline36dicarboxylate
CCOCCOC(=O)C1=C(NC2=C(C1C3=COC4=CC=CC=C4C3=O)C(=O)C(C(C2)C)C(=O)OC)C
InChI=1SC27H29NO8c153410113527(32)2115(3)28181214(2)20(26(31)334)25(30)23(18)22(21)17133619976816(19)24(17)29h691314202228H51012H214H3
MFCD05026929
ZINC000020169216
ZINC000034706255
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