Vitas-M small molecule compound
(E)-(4-butoxyphenyl){2-(4-hydroxyphenyl)-1-[3-(morpholin-4-ium-4-yl)propyl]-4,5-dioxopyrrolidin-3-ylidene}methanolate
Catalog ID
STL048769
SMILES CCCCOc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1ccc(cc1)O)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 C28H34N2O6 MW 494.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H34N2O6/c1-2-3-17-36-23-11-7-21(8-12-23)26(32)24-25(20-5-9-22(31)10-6-20)30(28(34)27(24)33)14-4-13-29-15-18-35-19-16-29/h5-12,25,31-32H,2-4,13-19H2,1H3/b26-24+InChIKey
OERRWHACAJZMIN-SHHOIMCASA-NSynonyms
848747-51-3(4E)4((4BUTOXYPHENYL)HYDROXYMETHYLIDENE)5(4HYDROXYPHENYL)1(3MORPHOLIN4YLPROPYL)PYRROLIDINE23DIONE
(E)(4butoxyphenyl)(2(4hydroxyphenyl)1(3(morpholin4ium4yl)propyl)45dioxopyrrolidin3ylidene)methanolate
(E)(4BUTOXYPHENYL)(2(4HYDROXYPHENYL)1(3MORPHOLIN4IUM4YLPROPYL)45DIOXOPYRROLIDIN3YLIDENE)METHANOLATE
848747513
CCCCOC1=CC=C(C=C1)C(=C2C(N(C(=O)C2=O)CCC(NH+)3CCOCC3)C4=CC=C(C=C4)O)(O)
CCCCOc1ccc(cc1)C(=C1C(=O)C(=O)N(C1c1ccc(cc1)O)CCC(NH+)1CCOCC1)(O)
InChI=1SC28H34N2O6c12317362311721(81223)26(32)2425(205922(31)10620)30(28(34)27(24)33)1441329151835191629h512253132H241319H21H3b2624+
MFCD18249224
ZINC000102884812
ZINC000102884814
Check stock
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