Vitas-M small molecule compound
(E)-[2-(4-hydroxy-3-methoxyphenyl)-4,5-dioxo-1-(pyridinium-3-ylmethyl)pyrrolidin-3-ylidene]{4-[(2-methylbenzyl)oxy]phenyl}methanolate
Catalog ID
STK561301
SMILES COc1cc(ccc1O)C1/C(=C(/c2ccc(cc2)OCc2ccccc2C)\[O-])/C(=O)C(=O)N1Cc1ccc[nH+]c1
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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 C32H28N2O6 MW 536.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H28N2O6/c1-20-6-3-4-8-24(20)19-40-25-12-9-22(10-13-25)30(36)28-29(23-11-14-26(35)27(16-23)39-2)34(32(38)31(28)37)18-21-7-5-15-33-17-21/h3-17,29,35-36H,18-19H2,1-2H3/b30-28+InChIKey
LLQWUZWEHUUGHT-SJCQXOIGSA-NSynonyms
573705-54-1(4E)5(4HYDROXY3METHOXYPHENYL)4(HYDROXY(4((2METHYLPHENYL)METHOXY)PHENYL)METHYLIDENE)1(PYRIDIN3YLMETHYL)PYRROLIDINE23DIONE
(E)(2(4HYDROXY3METHOXYPHENYL)45DIOXO1(PYRIDIN1IUM3YLMETHYL)PYRROLIDIN3YLIDENE)(4((2METHYLPHENYL)METHOXY)PHENYL)METHANOLATE
(E)(2(4hydroxy3methoxyphenyl)45dioxo1(pyridinium3ylmethyl)pyrrolidin3ylidene)(4((2methylbenzyl)oxy)phenyl)methanolate
573705541
CC1=CC=CC=C1COC2=CC=C(C=C2)C(=C3C(N(C(=O)C3=O)CC4=C(NH+)=CC=C4)C5=CC(=C(C=C5)O)OC)(O)
COc1cc(ccc1O)C1C(=C(c2ccc(cc2)OCc2ccccc2C)(O))C(=O)C(=O)N1Cc1ccc(nH+)c1
InChI=1SC32H28N2O6c120634824(20)19402512922(101325)30(36)2829(23111426(35)27(1623)392)34(32(38)31(28)37)18217515331721h317293536H1819H212H3b3028+
MFCD18243757
ZINC000102502923
ZINC000102502931
Check stock
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