Vitas-M small molecule compound

(E)-(3-methoxyphenyl){2-(4-methoxyphenyl)-1-[3-(morpholin-4-ium-4-yl)propyl]-4,5-dioxopyrrolidin-3-ylidene}methanolate

Catalog ID
STK560324
SMILES COc1ccc(cc1)C1N(CCC[NH+]2CCOCC2)C(=O)C(=O)/C/1=C(\c1cccc(c1)OC)/[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 C26H30N2O6 MW 466.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H30N2O6/c1-32-20-9-7-18(8-10-20)23-22(24(29)19-5-3-6-21(17-19)33-2)25(30)26(31)28(23)12-4-11-27-13-15-34-16-14-27/h3,5-10,17,23,29H,4,11-16H2,1-2H3/b24-22+
InChIKey
BHGVIUYBOYBKHU-ZNTNEXAZSA-N
Synonyms

(4E)4(HYDROXY(3METHOXYPHENYL)METHYLIDENE)5(4METHOXYPHENYL)1(3MORPHOLIN4YLPROPYL)PYRROLIDINE23DIONE
(E)(3methoxyphenyl)(2(4methoxyphenyl)1(3(morpholin4ium4yl)propyl)45dioxopyrrolidin3ylidene)methanolate
(E)(3METHOXYPHENYL)(2(4METHOXYPHENYL)1(3MORPHOLIN4IUM4YLPROPYL)45DIOXOPYRROLIDIN3YLIDENE)METHANOLATE
3HYDROXY5(4METHOXYPHENYL)4((3METHOXYPHENYL)CARBONYL)1(3MORPHOLIN4YLPROPYL)3PYRROLIN2ONE
COC1=CC=C(C=C1)C2C(=C(C3=CC(=CC=C3)OC)(O))C(=O)C(=O)N2CCC(NH+)4CCOCC4
COc1ccc(cc1)C1N(CCC(NH+)2CCOCC2)C(=O)C(=O)C1=C(c1cccc(c1)OC)(O)
InChI=1SC26H30N2O6c132209718(81020)2322(24(29)1953621(1719)332)25(30)26(31)28(23)1241127131534161427h3510172329H41116H212H3b2422+
MFCD18243502
ZINC000009007654
ZINC000009007655

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Available files

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