Vitas-M small molecule compound
3-hydroxy-4-[(4-methoxyphenyl)acetyl]-2-[(4-methylpiperazin-1-ium-1-yl)methyl]phenolate
Catalog ID
STK940418
SMILES COc1ccc(cc1)CC(=O)c1ccc(c(c1O)C[NH+]1CCN(CC1)C)[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 C21H26N2O4 MW 370.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H26N2O4/c1-22-9-11-23(12-10-22)14-18-19(24)8-7-17(21(18)26)20(25)13-15-3-5-16(27-2)6-4-15/h3-8,24,26H,9-14H2,1-2H3InChIKey
PUMZVTZHCYKWQF-UHFFFAOYSA-NSynonyms
1021206-04-11(24DIHYDROXY3((4METHYLPIPERAZINYL)METHYL)PHENYL)2(4METHOXYPHENYL)ETHAN1ONE
1021206041
3hydroxy4((4methoxyphenyl)acetyl)2((4methylpiperazin1ium1yl)methyl)phenolate
3hydroxy6(2(4methoxyphenyl)acetyl)2((4methylpiperazin1ium1yl)methyl)phenolate
CN1CC(NH+)(CC1)CC2=C(C=CC(=C2(O))C(=O)CC3=CC=C(C=C3)OC)O
COc1ccc(cc1)CC(=O)c1ccc(c(c1O)C(NH+)1CCN(CC1)C)(O)
InChI=1SC21H26N2O4c12291123(121022)141819(24)8717(21(18)26)20(25)13153516(272)6415h382426H914H212H3
MFCD12007602
ZINC000022854464
ZINC22854464
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