Vitas-M small molecule compound
tetrahydrofuran-2-ylmethyl 4-(6-chloro-4-oxo-4H-chromen-3-yl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK363807
SMILES Clc1ccc2c(c1)c(=O)c(co2)C1C(=C(C)NC2=C1C(=O)CCC2)C(=O)OCC1CCCO1
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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 C25H24ClNO6 MW 469.92 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H24ClNO6/c1-13-21(25(30)33-11-15-4-3-9-31-15)22(23-18(27-13)5-2-6-19(23)28)17-12-32-20-8-7-14(26)10-16(20)24(17)29/h7-8,10,12,15,22,27H,2-6,9,11H2,1H3InChIKey
LBKOTIGYVPHQJZ-UHFFFAOYSA-NSynonyms
CC1=C(C(C2=C(N1)CCCC2=O)C3=COC4=C(C3=O)C=C(C=C4)Cl)C(=O)OCC5CCCO5
InChI=1SC25H24ClNO6c11321(25(30)3311154393115)22(2318(2713)52619(23)28)171232208714(26)1016(20)24(17)29h781012152227H26911H21H3
MFCD01824513
oxolan2ylmethyl4(6chloro4oxochromen3yl)2methyl5oxo4678tetrahydro1Hquinoline3carboxylate
tetrahydrofuran2ylmethyl4(6chloro4oxo4Hchromen3yl)2methyl5oxo145678hexahydroquinoline3carboxylate
ZINC000100590273
ZINC000100590280
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