Vitas-M small molecule compound

(2Z)-7-{[bis(2-methoxyethyl)ammonio]methyl}-2-[(5-methylfuran-2-yl)methylidene]-3-oxo-2,3-dihydro-1-benzofuran-6-olate

Catalog ID
STK852130
SMILES COCC[NH+](Cc1c([O-])ccc2c1O/C(=C\c1ccc(o1)C)/C2=O)CCOC

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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 C21H25NO6 MW 387.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H25NO6/c1-14-4-5-15(27-14)12-19-20(24)16-6-7-18(23)17(21(16)28-19)13-22(8-10-25-2)9-11-26-3/h4-7,12,23H,8-11,13H2,1-3H3/b19-12-
InChIKey
DPVMFSSQCHEBLZ-UNOMPAQXSA-N
Synonyms
900262-11-5
(2Z)7((BIS(2METHOXYETHYL)AMINO)METHYL)2((5METHYLFURAN2YL)METHYLIDENE)6OXIDANYL1BENZOFURAN3ONE
(2Z)7((BIS(2METHOXYETHYL)AMINO)METHYL)6HYDROXY2((5METHYL2FURANYL)METHYLIDENE)3BENZOFURANONE
(2Z)7((BIS(2METHOXYETHYL)AMINO)METHYL)6HYDROXY2((5METHYL2FURYL)METHYLENE)COUMARAN3ONE
(2Z)7((BIS(2METHOXYETHYL)AMINO)METHYL)6HYDROXY2((5METHYLFURAN2YL)METHYLIDENE)1BENZOFURAN3ONE
(2Z)7((bis(2methoxyethyl)ammonio)methyl)2((5methylfuran2yl)methylidene)3oxo23dihydro1benzofuran6olate
7((BIS(2METHOXYETHYL)AMINO)METHYL)6HYDROXY2((5METHYL(2FURYL))METHYLENE)BENZO(B)FURAN3ONE
900262115
CC1=CC=C(O1)C=C2C(=O)C3=C(O2)C(=C(C=C3)O)CN(CCOC)CCOC
COCC(NH+)(Cc1c((O))ccc2c1OC(=Cc1ccc(o1)C)C2=O)CCOC
InChI=1SC21H25NO6c1144515(2714)121920(24)166718(23)17(21(16)2819)1322(810252)911263h471223H81113H213H3b1912
MFCD06610726
ZINC000002350878
ZINC02350878
ZINC2350878

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Available files

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