Vitas-M small molecule compound
3-(2-ethoxyphenoxy)-2-methyl-4-oxo-8-(pyrrolidinium-1-ylmethyl)-4H-chromen-7-olate
Catalog ID
STK589760
SMILES CCOc1ccccc1Oc1c(C)oc2c(c1=O)ccc(c2C[NH+]1CCCC1)[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 C23H25NO5 MW 395.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H25NO5/c1-3-27-19-8-4-5-9-20(19)29-22-15(2)28-23-16(21(22)26)10-11-18(25)17(23)14-24-12-6-7-13-24/h4-5,8-11,25H,3,6-7,12-14H2,1-2H3InChIKey
VULJBWKHMWPDGL-UHFFFAOYSA-NSynonyms
846584-12-13(2ethoxyphenoxy)2methyl4oxo8(pyrrolidin1ium1ylmethyl)chromen7olate
3(2ethoxyphenoxy)2methyl4oxo8(pyrrolidinium1ylmethyl)4Hchromen7olate
CCOC1=CC=CC=C1OC2=C(OC3=C(C2=O)C=CC(=C3C(NH+)4CCCC4)(O))C
CCOc1ccccc1Oc1c(C)oc2c(c1=O)ccc(c2C(NH+)1CCCC1)(O)
InChI=1SC23H25NO5c132719845920(19)292215(2)282316(21(22)26)101118(25)17(23)142412671324h4581125H3671214H212H3
MFCD04177515
ZINC000020393733
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