Vitas-M small molecule compound
8-{[4-(2-hydroxyethyl)piperazin-1-ium-1-yl]methyl}-2-methyl-4-oxo-3-[4-(propoxycarbonyl)phenoxy]-4H-chromen-7-olate
Catalog ID
STK587211
SMILES CCCOC(=O)c1ccc(cc1)Oc1c(C)oc2c(c1=O)ccc(c2C[NH+]1CCN(CC1)CCO)[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 C27H32N2O7 MW 496.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H32N2O7/c1-3-16-34-27(33)19-4-6-20(7-5-19)36-25-18(2)35-26-21(24(25)32)8-9-23(31)22(26)17-29-12-10-28(11-13-29)14-15-30/h4-9,30-31H,3,10-17H2,1-2H3InChIKey
INQCPWVCSIOIQX-UHFFFAOYSA-NSynonyms
724741-03-18((4(2hydroxyethyl)piperazin1ium1yl)methyl)2methyl4oxo3(4(propoxycarbonyl)phenoxy)4Hchromen7olate
CCCOC(=O)C1=CC=C(C=C1)OC2=C(OC3=C(C2=O)C=CC(=C3CN4CCN(CC4)CCO)O)C
CCCOC(=O)c1ccc(cc1)Oc1c(C)oc2c(c1=O)ccc(c2C(NH+)1CCN(CC1)CCO)(O)
InChI=1SC27H32N2O7c13163427(33)194620(7519)362518(2)352621(24(25)32)8923(31)22(26)1729121028(111329)141530h493031H31017H212H3
MFCD04160150
ZINC000019924472
Check stock
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