Vitas-M small molecule compound
(E)-{2-(furan-2-yl)-1-[3-(morpholin-4-ium-4-yl)propyl]-4,5-dioxopyrrolidin-3-ylidene}{4-[(2-methylbenzyl)oxy]phenyl}methanolate
Catalog ID
STL150002
SMILES O=C1C(=O)/C(=C(\c2ccc(cc2)OCc2ccccc2C)/[O-])/C(N1CCC[NH+]1CCOCC1)c1ccco1
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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 C30H32N2O6 MW 516.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H32N2O6/c1-21-6-2-3-7-23(21)20-38-24-11-9-22(10-12-24)28(33)26-27(25-8-4-17-37-25)32(30(35)29(26)34)14-5-13-31-15-18-36-19-16-31/h2-4,6-12,17,27,33H,5,13-16,18-20H2,1H3/b28-26+InChIKey
MZSFRIRMSMHGTD-BYCLXTJYSA-NSynonyms
840509-00-4(4E)5(FURAN2YL)4(HYDROXY(4((2METHYLPHENYL)METHOXY)PHENYL)METHYLIDENE)1(3MORPHOLIN4YLPROPYL)PYRROLIDINE23DIONE
(E)(2(furan2yl)1(3(morpholin4ium4yl)propyl)45dioxopyrrolidin3ylidene)(4((2methylbenzyl)oxy)phenyl)methanolate
(E)(2(FURAN2YL)1(3MORPHOLIN4IUM4YLPROPYL)45DIOXOPYRROLIDIN3YLIDENE)(4((2METHYLPHENYL)METHOXY)PHENYL)METHANOLATE
840509004
CC1=CC=CC=C1COC2=CC=C(C=C2)C(=C3C(N(C(=O)C3=O)CCC(NH+)4CCOCC4)C5=CC=CO5)(O)
InChI=1SC30H32N2O6c121623723(21)20382411922(101224)28(33)2627(2584173725)32(30(35)29(26)34)1451331151836191631h24612172733H513161820H21H3b2826+
MFCD20755717
O=C1C(=O)C(=C(c2ccc(cc2)OCc2ccccc2C)(O))C(N1CCC(NH+)1CCOCC1)c1ccco1
ZINC000102931218
ZINC000102931221
Check stock
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Check stock on Vitas-MAvailable files
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