Vitas-M small molecule compound
3-(3-methoxyphenoxy)-8-[(2-methylpiperidinium-1-yl)methyl]-4-oxo-4H-chromen-7-olate
Catalog ID
STK567342
SMILES COc1cccc(c1)Oc1coc2c(c1=O)ccc(c2C[NH+]1CCCCC1C)[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 C23H25NO5 MW 395.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H25NO5/c1-15-6-3-4-11-24(15)13-19-20(25)10-9-18-22(26)21(14-28-23(18)19)29-17-8-5-7-16(12-17)27-2/h5,7-10,12,14-15,25H,3-4,6,11,13H2,1-2H3InChIKey
NKOSXXUTYNCMTD-UHFFFAOYSA-NSynonyms
848220-09-73(3METHOXYPHENOXY)8((2METHYLPIPERIDIN1IUM1YL)METHYL)4OXOCHROMEN7OLATE
3(3methoxyphenoxy)8((2methylpiperidinium1yl)methyl)4oxo4Hchromen7olate
7HYDROXY3(3METHOXYPHENOXY)8((2METHYLPIPERIDIN1YL)METHYL)CHROMEN4ONE
7HYDROXY3(3METHOXYPHENOXY)8((2METHYLPIPERIDYL)METHYL)CHROMEN4ONE
CC1CCCC(NH+)1CC2=C(C=CC3=C2OC=C(C3=O)OC4=CC(=CC=C4)OC)(O)
COc1cccc(c1)Oc1coc2c(c1=O)ccc(c2C(NH+)1CCCCC1C)(O)
InChI=1SC23H25NO5c1156341124(15)131920(25)1091822(26)21(142823(18)19)291785716(1217)272h571012141525H3461113H212H3
MFCD04189711
ZINC000005219026
ZINC000005219028
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