Vitas-M small molecule compound
(2Z)-2-(1-benzofuran-2-ylmethylidene)-7-{[bis(2-methoxyethyl)amino]methyl}-6-hydroxy-4-methyl-1-benzofuran-3(2H)-one
Catalog ID
STL035037
SMILES COCCN(Cc1c(O)cc(c2c1O/C(=C\c1cc3c(o1)cccc3)/C2=O)C)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 C25H27NO6 MW 437.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H27NO6/c1-16-12-20(27)19(15-26(8-10-29-2)9-11-30-3)25-23(16)24(28)22(32-25)14-18-13-17-6-4-5-7-21(17)31-18/h4-7,12-14,27H,8-11,15H2,1-3H3/b22-14-InChIKey
XAPZQBQPWXAQQB-HMAPJEAMSA-NSynonyms
929820-04-2(2Z)2(1benzofuran2ylmethylidene)7((bis(2methoxyethyl)amino)methyl)6hydroxy4methyl1benzofuran3(2H)one
(2Z)2(1benzofuran2ylmethylidene)7((bis(2methoxyethyl)azaniumyl)methyl)4methyl3oxo1benzofuran6olate
(E)2(benzofuran2ylmethylene)7((bis(2methoxyethyl)amino)methyl)6hydroxy4methylbenzofuran3(2H)one
2(BENZO(D)FURAN2YLMETHYLENE)7((BIS(2METHOXYETHYL)AMINO)METHYL)6HYDROXY4METHYLBENZO(B)FURAN3ONE
929820042
CC1=CC(=C(C2=C1C(=O)C(=CC3=CC4=CC=CC=C4O3)O2)C(NH+)(CCOC)CCOC)(O)
COCCN(Cc1c(O)cc(c2c1OC(=Cc1cc3c(o1)cccc3)C2=O)C)CCOC
InChI=1SC25H27NO6c1161220(27)19(1526(810292)911303)2523(16)24(28)22(3225)14181317645721(17)3118h47121427H81115H213H3b2214
MFCD11999733
ZINC000023127135
ZINC23127135
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