Vitas-M small molecule compound
2-(5-{(E)-[(1,3-dioxooctahydro-4,6-ethenocyclopropa[f]isoindol-2(1H)-yl)imino]methyl}furan-2-yl)benzoic acid
Catalog ID
STK264368
SMILES O=C1N(/N=C/c2ccc(o2)c2ccccc2C(=O)O)C(=O)C2C1C1C=CC2C2C1C2
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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 C23H18N2O5 MW 402.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H18N2O5/c26-21-19-13-6-7-14(17-9-16(13)17)20(19)22(27)25(21)24-10-11-5-8-18(30-11)12-3-1-2-4-15(12)23(28)29/h1-8,10,13-14,16-17,19-20H,9H2,(H,28,29)/b24-10+InChIKey
YRFQQLVZCFAHQD-YSURURNPSA-NSynonyms
2(5((E)((13dioxooctahydro46ethenocyclopropa(f)isoindol2(1H)yl)imino)methyl)furan2yl)benzoicacid
C1C2C1C3C=CC2C4C3C(=O)N(C4=O)N=CC5=CC=C(O5)C6=CC=CC=C6C(=O)O
InChI=1SC23H18N2O5c262119136714(17916(13)17)20(19)22(27)25(21)2410115818(3011)12312415(12)23(28)29h1810131416171920H9H2(H2829)b2410+
MFCD02294249
O=C1N(N=Cc2ccc(o2)c2ccccc2C(=O)O)C(=O)C2C1C1C=CC2C2C1C2
ZINC000252428751
ZINC000252428754
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