Vitas-M small molecule compound
(E)-[2-(4-hydroxyphenyl)-4,5-dioxo-1-(pyridinium-3-ylmethyl)pyrrolidin-3-ylidene](4-propoxyphenyl)methanolate
Catalog ID
STK568778
SMILES CCCOc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1ccc(cc1)O)Cc1ccc[nH+]c1)/[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 C26H24N2O5 MW 444.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H24N2O5/c1-2-14-33-21-11-7-19(8-12-21)24(30)22-23(18-5-9-20(29)10-6-18)28(26(32)25(22)31)16-17-4-3-13-27-15-17/h3-13,15,23,29-30H,2,14,16H2,1H3/b24-22+InChIKey
WSVSMSNGKZTMFB-ZNTNEXAZSA-NSynonyms
(4E)5(4HYDROXYPHENYL)4(HYDROXY(4PROPOXYPHENYL)METHYLIDENE)1(PYRIDIN3YLMETHYL)PYRROLIDINE23DIONE
(E)(2(4HYDROXYPHENYL)45DIOXO1(PYRIDIN1IUM3YLMETHYL)PYRROLIDIN3YLIDENE)(4PROPOXYPHENYL)METHANOLATE
(E)(2(4hydroxyphenyl)45dioxo1(pyridinium3ylmethyl)pyrrolidin3ylidene)(4propoxyphenyl)methanolate
CCCOC1=CC=C(C=C1)C(=C2C(N(C(=O)C2=O)CC3=C(NH+)=CC=C3)C4=CC=C(C=C4)O)(O)
CCCOc1ccc(cc1)C(=C1C(=O)C(=O)N(C1c1ccc(cc1)O)Cc1ccc(nH+)c1)(O)
InChI=1SC26H24N2O5c1214332111719(81221)24(30)2223(185920(29)10618)28(26(32)25(22)31)16174313271517h31315232930H21416H21H3b2422+
MFCD18245253
ZINC000102554228
ZINC000102554239
Check stock
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