Vitas-M small molecule compound
oxydibenzene-4,1-diyl bis(1,3-dioxo-2-{4-[(1E)-3-oxo-3-phenylprop-1-en-1-yl]phenyl}-2,3-dihydro-1H-isoindole-5-carboxylate)
Catalog ID
STK669706
SMILES O=C(c1ccc2c(c1)C(=O)N(C2=O)c1ccc(cc1)/C=C/C(=O)c1ccccc1)Oc1ccc(cc1)Oc1ccc(cc1)OC(=O)c1ccc2c(c1)C(=O)N(C2=O)c1ccc(cc1)/C=C/C(=O)c1ccccc1
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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 C60H36N2O11 MW 960.95 g/mol Purity >90% as per NMR
InChI
InChI=1S/C60H36N2O11/c63-53(39-7-3-1-4-8-39)33-15-37-11-19-43(20-12-37)61-55(65)49-31-17-41(35-51(49)57(61)67)59(69)72-47-27-23-45(24-28-47)71-46-25-29-48(30-26-46)73-60(70)42-18-32-50-52(36-42)58(68)62(56(50)66)44-21-13-38(14-22-44)16-34-54(64)40-9-5-2-6InChIKey
CIVHDKXNINJZFV-KXJQYHRCSA-NSynonyms
C1=CC=C(C=C1)C(=O)C=CC2=CC=C(C=C2)N3C(=O)C4=C(C3=O)C=C(C=C4)C(=O)OC5=CC=C(C=C5)OC6=CC=C(C=C6)OC(=O)C7=CC8=C(C=C7)C(=O)N(C8=O)C9=CC=C(C=C9)C=CC(=O)C1=CC=CC=C1
InChI=1SC60H36N2O11c6353(397314839)331537111943(201237)6155(65)49311741(3551(49)57(61)67)59(69)7247272345(242847)7146252948(302646)7360(70)4218325052(3642)58(68)62(56(50)66)44211338(142244)163454(64)4095261040h136Hb3315+3416+
MFCD00735628
O=C(c1ccc2c(c1)C(=O)N(C2=O)c1ccc(cc1)C=CC(=O)c1ccccc1)Oc1ccc(cc1)Oc1ccc(cc1)OC(=O)c1ccc2c(c1)C(=O)N(C2=O)c1ccc(cc1)C=CC(=O)c1ccccc1
oxydibenzene41diylbis(13dioxo2(4((1E)3oxo3phenylprop1en1yl)phenyl)23dihydro1Hisoindole5carboxylate)
ZINC000150349221
ZINC150349221
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