Vitas-M small molecule compound
3-cyclopentyl 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
STK404446
SMILES COC(=O)C1C(C)CC2=C(C1=O)C(C(=C(N2)C)C(=O)OC1CCCC1)c1coc2c(c1=O)cccc2
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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 C28H29NO7 MW 491.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H29NO7/c1-14-12-19-24(26(31)21(14)27(32)34-3)23(18-13-35-20-11-7-6-10-17(20)25(18)30)22(15(2)29-19)28(33)36-16-8-4-5-9-16/h6-7,10-11,13-14,16,21,23,29H,4-5,8-9,12H2,1-3H3InChIKey
KTOQZVRPWGJLAR-UHFFFAOYSA-NSynonyms
3cyclopentyl6methyl27dimethyl5oxo4(4oxo4Hchromen3yl)145678hexahydroquinoline36dicarboxylate
3Ocyclopentyl6Omethyl27dimethyl5oxo4(4oxochromen3yl)4678tetrahydro1Hquinoline36dicarboxylate
CC1CC2=C(C(C(=C(N2)C)C(=O)OC3CCCC3)C4=COC5=CC=CC=C5C4=O)C(=O)C1C(=O)OC
InChI=1SC28H29NO7c114121924(26(31)21(14)27(32)343)23(1813352011761017(20)25(18)30)22(15(2)2919)28(33)3616845916h671011131416212329H458912H213H3
MFCD04220123
ZINC000020352119
ZINC000101913832
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