Vitas-M small molecule compound

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

Catalog ID
STL148420
SMILES COc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1ccccc1OC)CCC[NH+]1CCOCC1)/[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/c1-32-19-10-8-18(9-11-19)24(29)22-23(20-6-3-4-7-21(20)33-2)28(26(31)25(22)30)13-5-12-27-14-16-34-17-15-27/h3-4,6-11,23,29H,5,12-17H2,1-2H3/b24-22+
InChIKey
TZXZYQUQZOAJRC-ZNTNEXAZSA-N
Synonyms
488859-56-9
(4E)4(HYDROXY(4METHOXYPHENYL)METHYLIDENE)5(2METHOXYPHENYL)1(3MORPHOLIN4YLPROPYL)PYRROLIDINE23DIONE
(E)(4methoxyphenyl)(2(2methoxyphenyl)1(3(morpholin4ium4yl)propyl)45dioxopyrrolidin3ylidene)methanolate
(E)(4METHOXYPHENYL)(2(2METHOXYPHENYL)1(3MORPHOLIN4IUM4YLPROPYL)45DIOXOPYRROLIDIN3YLIDENE)METHANOLATE
488859569
COC1=CC=C(C=C1)C(=C2C(N(C(=O)C2=O)CCCN3CCOCC3)C4=CC=CC=C4OC)O
COc1ccc(cc1)C(=C1C(=O)C(=O)N(C1c1ccccc1OC)CCC(NH+)1CCOCC1)(O)
InChI=1SC26H30N2O6c1321910818(91119)24(29)2223(20634721(20)332)28(26(31)25(22)30)1351227141634171527h346112329H51217H212H3b2422+
MFCD20755392
ZINC000102927769
ZINC000102927773

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Available files

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