Vitas-M small molecule compound
(E)-[2-(3-ethoxy-4-hydroxyphenyl)-4,5-dioxo-1-(pyridinium-3-ylmethyl)pyrrolidin-3-ylidene][3-methyl-4-(2-methylpropoxy)phenyl]methanolate
Catalog ID
STL037233
SMILES CCOc1cc(ccc1O)C1N(Cc2ccc[nH+]c2)C(=O)C(=O)/C/1=C(\c1ccc(c(c1)C)OCC(C)C)/[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 C30H32N2O6 MW 516.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H32N2O6/c1-5-37-25-14-21(8-10-23(25)33)27-26(29(35)30(36)32(27)16-20-7-6-12-31-15-20)28(34)22-9-11-24(19(4)13-22)38-17-18(2)3/h6-15,18,27,33-34H,5,16-17H2,1-4H3/b28-26+InChIKey
WHGPOGYOGHLULS-BYCLXTJYSA-NSynonyms
488709-44-0(4E)5(3ETHOXY4HYDROXYPHENYL)4(HYDROXY(3METHYL4(2METHYLPROPOXY)PHENYL)METHYLIDENE)1(PYRIDIN3YLMETHYL)PYRROLIDINE23DIONE
(E)(2(3ETHOXY4HYDROXYPHENYL)45DIOXO1(PYRIDIN1IUM3YLMETHYL)PYRROLIDIN3YLIDENE)(3METHYL4(2METHYLPROPOXY)PHENYL)METHANOLATE
(E)(2(3ethoxy4hydroxyphenyl)45dioxo1(pyridinium3ylmethyl)pyrrolidin3ylidene)(3methyl4(2methylpropoxy)phenyl)methanolate
488709440
CCOC1=C(C=CC(=C1)C2C(=C(C3=CC(=C(C=C3)OCC(C)C)C)O)C(=O)C(=O)N2CC4=CN=CC=C4)O
CCOc1cc(ccc1O)C1N(Cc2ccc(nH+)c2)C(=O)C(=O)C1=C(c1ccc(c(c1)C)OCC(C)C)(O)
InChI=1SC30H32N2O6c1537251421(81023(25)33)2726(29(35)30(36)32(27)16207612311520)28(34)2291124(19(4)1322)381718(2)3h61518273334H51617H214H3b2826+
MFCD18247387
ZINC000102858959
ZINC000102858962
Check stock
See real-time availability and sample size for STL037233 on the Vitas-M platform.
Check stock on Vitas-MAvailable files
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