Vitas-M small molecule compound
8-{[4-(2-hydroxyethyl)piperazin-1-ium-1-yl]methyl}-5-methoxy-4-oxo-2-phenyl-4H-chromen-7-olate
Catalog ID
STK619325
SMILES OCCN1CC[NH+](CC1)Cc1c([O-])cc(c2c1oc(cc2=O)c1ccccc1)OC
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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 C23H26N2O5 MW 410.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H26N2O5/c1-29-21-13-18(27)17(15-25-9-7-24(8-10-25)11-12-26)23-22(21)19(28)14-20(30-23)16-5-3-2-4-6-16/h2-6,13-14,26-27H,7-12,15H2,1H3InChIKey
RAOVIVFCXSOPOO-UHFFFAOYSA-NSynonyms
921118-89-07HYDROXY8((4(2HYDROXYETHYL)PIPERAZINYL)METHYL)5METHOXY2PHENYLCHROMEN4ONE
8((4(2hydroxyethyl)piperazin1ium1yl)methyl)5methoxy4oxo2phenyl4Hchromen7olate
8((4(2hydroxyethyl)piperazin1ium1yl)methyl)5methoxy4oxo2phenylchromen7olate
COC1=C2C(=O)C=C(OC2=C(C(=C1)(O))C(NH+)3CCN(CC3)CCO)C4=CC=CC=C4
InChI=1SC23H26N2O5c129211318(27)17(15259724(81025)111226)2322(21)19(28)1420(3023)165324616h2613142627H71215H21H3
MFCD08748621
OCCN1CC(NH+)(CC1)Cc1c((O))cc(c2c1oc(cc2=O)c1ccccc1)OC
ZINC000020623441
ZINC20623441
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