Vitas-M small molecule compound
3-[4-(methoxycarbonyl)phenoxy]-4-oxo-8-(piperidinium-1-ylmethyl)-4H-chromen-7-olate
Catalog ID
STK599557
SMILES COC(=O)c1ccc(cc1)Oc1coc2c(c1=O)ccc(c2C[NH+]1CCCCC1)[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 C23H23NO6 MW 409.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H23NO6/c1-28-23(27)15-5-7-16(8-6-15)30-20-14-29-22-17(21(20)26)9-10-19(25)18(22)13-24-11-3-2-4-12-24/h5-10,14,25H,2-4,11-13H2,1H3InChIKey
FIWIPIOCGSXUTE-UHFFFAOYSA-NSynonyms
637752-59-13(4(methoxycarbonyl)phenoxy)4oxo8(piperidinium1ylmethyl)4Hchromen7olate
3(4methoxycarbonylphenoxy)4oxo8(piperidin1ium1ylmethyl)chromen7olate
COC(=O)C1=CC=C(C=C1)OC2=COC3=C(C2=O)C=CC(=C3C(NH+)4CCCCC4)(O)
COC(=O)c1ccc(cc1)Oc1coc2c(c1=O)ccc(c2C(NH+)1CCCCC1)(O)
InChI=1SC23H23NO6c12823(27)155716(8615)302014292217(21(20)26)91019(25)18(22)1324113241224h5101425H241113H21H3
MFCD04186730
ZINC000020438524
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