Vitas-M small molecule compound
(E)-[4-(benzyloxy)-2-methylphenyl]{2-(4-hydroxy-3-methoxyphenyl)-1-[2-(morpholin-4-ium-4-yl)ethyl]-4,5-dioxopyrrolidin-3-ylidene}methanolate
Catalog ID
STL147939
SMILES COc1cc(ccc1O)C1N(CC[NH+]2CCOCC2)C(=O)C(=O)/C/1=C(\c1ccc(cc1C)OCc1ccccc1)/[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 C32H34N2O7 MW 558.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H34N2O7/c1-21-18-24(41-20-22-6-4-3-5-7-22)9-10-25(21)30(36)28-29(23-8-11-26(35)27(19-23)39-2)34(32(38)31(28)37)13-12-33-14-16-40-17-15-33/h3-11,18-19,29,35-36H,12-17,20H2,1-2H3/b30-28+InChIKey
ZVNZWCQVARNZBR-SJCQXOIGSA-NSynonyms
(4E)5(4HYDROXY3METHOXYPHENYL)4(HYDROXY(2METHYL4PHENYLMETHOXYPHENYL)METHYLIDENE)1(2MORPHOLIN4YLETHYL)PYRROLIDINE23DIONE
(E)(2(4HYDROXY3METHOXYPHENYL)1(2MORPHOLIN4IUM4YLETHYL)45DIOXOPYRROLIDIN3YLIDENE)(2METHYL4PHENYLMETHOXYPHENYL)METHANOLATE
(E)(4(benzyloxy)2methylphenyl)(2(4hydroxy3methoxyphenyl)1(2(morpholin4ium4yl)ethyl)45dioxopyrrolidin3ylidene)methanolate
4(4(BENZYLOXY)2METHYLBENZOYL)3HYDROXY5(4HYDROXY3METHOXYPHENYL)1(2MORPHOLINOETHYL)1HPYRROL2(5H)ONE
CC1=C(C=CC(=C1)OCC2=CC=CC=C2)C(=C3C(N(C(=O)C3=O)CCN4CCOCC4)C5=CC(=C(C=C5)O)OC)O
COc1cc(ccc1O)C1N(CC(NH+)2CCOCC2)C(=O)C(=O)C1=C(c1ccc(cc1C)OCc1ccccc1)(O)
InChI=1SC32H34N2O7c1211824(4120226435722)91025(21)30(36)2829(2381126(35)27(1923)392)34(32(38)31(28)37)131233141640171533h3111819293536H121720H212H3b3028+
MFCD20755296
ZINC000102926101
ZINC000102926103
Check stock
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