Vitas-M small molecule compound
prop-2-en-1-yl 4-(4-hydroxy-3-methoxyphenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK372529
SMILES C=CCOC(=O)C1=C(C)NC2=C(C1c1ccc(c(c1)OC)O)C(=O)CCC2
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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 C21H23NO5 MW 369.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H23NO5/c1-4-10-27-21(25)18-12(2)22-14-6-5-7-16(24)20(14)19(18)13-8-9-15(23)17(11-13)26-3/h4,8-9,11,19,22-23H,1,5-7,10H2,2-3H3InChIKey
SAKKHSMGSATBOG-UHFFFAOYSA-NSynonyms
CC1=C(C(C2=C(N1)CCCC2=O)C3=CC(=C(C=C3)O)OC)C(=O)OCC=C
InChI=1SC21H23NO5c14102721(25)1812(2)221465716(24)20(14)19(18)138915(23)17(1113)263h48911192223H15710H223H3
MFCD00717931
prop2en1yl4(4hydroxy3methoxyphenyl)2methyl5oxo145678hexahydroquinoline3carboxylate
prop2enyl4(4hydroxy3methoxyphenyl)2methyl5oxo4678tetrahydro1Hquinoline3carboxylate
ZINC000003073706
ZINC000003073707
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