Vitas-M small molecule compound
8-[(diethylammonio)methyl]-2-methyl-4-oxo-3-[4-(propoxycarbonyl)phenoxy]-4H-chromen-7-olate
Catalog ID
STK568551
SMILES CCCOC(=O)c1ccc(cc1)Oc1c(C)oc2c(c1=O)ccc(c2C[NH+](CC)CC)[O-]
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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 C25H29NO6 MW 439.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H29NO6/c1-5-14-30-25(29)17-8-10-18(11-9-17)32-23-16(4)31-24-19(22(23)28)12-13-21(27)20(24)15-26(6-2)7-3/h8-13,27H,5-7,14-15H2,1-4H3InChIKey
QNFNYEMAXLJBMX-UHFFFAOYSA-NSynonyms
724741-09-78((diethylammonio)methyl)2methyl4oxo3(4(propoxycarbonyl)phenoxy)4Hchromen7olate
CCCOC(=O)C1=CC=C(C=C1)OC2=C(OC3=C(C2=O)C=CC(=C3CN(CC)CC)O)C
CCCOC(=O)c1ccc(cc1)Oc1c(C)oc2c(c1=O)ccc(c2C(NH+)(CC)CC)(O)
InChI=1SC25H29NO6c15143025(29)1781018(11917)322316(4)312419(22(23)28)121321(27)20(24)1526(62)73h81327H571415H214H3
MFCD04165420
ZINC000001873774
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Check stock on Vitas-MAvailable files
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