Vitas-M small molecule compound
3-(4-methoxyphenoxy)-4-oxo-8-(piperidinium-1-ylmethyl)-4H-chromen-7-olate
Catalog ID
STK581645
SMILES COc1ccc(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 C22H23NO5 MW 381.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H23NO5/c1-26-15-5-7-16(8-6-15)28-20-14-27-22-17(21(20)25)9-10-19(24)18(22)13-23-11-3-2-4-12-23/h5-10,14,24H,2-4,11-13H2,1H3InChIKey
QBMLEMYKEVZDGO-UHFFFAOYSA-NSynonyms
637751-84-93(4methoxyphenoxy)4oxo8(piperidin1ium1ylmethyl)chromen7olate
3(4methoxyphenoxy)4oxo8(piperidinium1ylmethyl)4Hchromen7olate
COC1=CC=C(C=C1)OC2=COC3=C(C2=O)C=CC(=C3C(NH+)4CCCCC4)(O)
COc1ccc(cc1)Oc1coc2c(c1=O)ccc(c2C(NH+)1CCCCC1)(O)
InChI=1SC22H23NO5c126155716(8615)282014272217(21(20)25)91019(24)18(22)1323113241223h5101424H241113H21H3
MFCD02341596
ZINC000020358382
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