Vitas-M small molecule compound
3-cyclopentyl 6-methyl 4-(1,3-benzodioxol-5-yl)-2,7-dimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3,6-dicarboxylate
Catalog ID
STK404515
SMILES COC(=O)C1C(C)CC2=C(C1=O)C(c1ccc3c(c1)OCO3)C(=C(N2)C)C(=O)OC1CCCC1
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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 C26H29NO7 MW 467.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H29NO7/c1-13-10-17-23(24(28)20(13)25(29)31-3)22(15-8-9-18-19(11-15)33-12-32-18)21(14(2)27-17)26(30)34-16-6-4-5-7-16/h8-9,11,13,16,20,22,27H,4-7,10,12H2,1-3H3InChIKey
LVZAWGXKFNVHAI-UHFFFAOYSA-NSynonyms
3cyclopentyl6methyl4(13benzodioxol5yl)27dimethyl5oxo145678hexahydroquinoline36dicarboxylate
3Ocyclopentyl6Omethyl4(13benzodioxol5yl)27dimethyl5oxo4678tetrahydro1Hquinoline36dicarboxylate
CC1CC2=C(C(C(=C(N2)C)C(=O)OC3CCCC3)C4=CC5=C(C=C4)OCO5)C(=O)C1C(=O)OC
InChI=1SC26H29NO7c113101723(24(28)20(13)25(29)313)22(15891819(1115)33123218)21(14(2)2717)26(30)3416645716h89111316202227H471012H213H3
MFCD04220713
ZINC000016361230
ZINC000239339219
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