This website is for informational and educational purposes only. Please do not self-medicate; contact a medical professional for advice before administration. This website is for informational and educational purposes only. Please do not self-medicate; contact a medical professional for advice before administration.

Meliternin

PubChem CID: 386319

Connections displayed (default: 10).
Loading graph...

Compound Synonyms Meliternin, Meliternix, NSC678095, 569-18-6, SCHEMBL9063848, CHEMBL1974356, 2-(1,3-benzodioxol-5-yl)-3,5,7,8-tetramethoxychromen-4-one, LMPK12113263, NSC-678095, NCI60_027966, 3,7,8-Tetramethoxy-3',4'-methylenedioxyflavone, 3,5,7,8-Tetramethoxy-3',4'-methylenedioxyflavone, 2-(1,3-Benzodioxol-5-yl)-3,5,7,8-tetramethoxy-4H-chromen-4-one, 2-(1,3-benzodioxol-5-yl)-3,5,7,8-tetramethoxy-chromen-4-one
Topological Polar Surface Area 81.7
Hydrogen Bond Donor Count 0.0
Heavy Atom Count 28.0
Isotope Atom Count 0.0
Molecular Complexity 619.0
Database Name cmaup_ingredients;npass_chem_all;pubchem
Defined Atom Stereocenter Count 0.0
Iupac Name 2-(1,3-benzodioxol-5-yl)-3,5,7,8-tetramethoxychromen-4-one
Prediction Hob 1.0
Xlogp 3.1
Molecular Formula C20H18O8
Prediction Swissadme 0.0
Inchi Key OHFDXRKYUVNEDD-UHFFFAOYSA-N
Fcsp3 0.25
Logs -5.009
Rotatable Bond Count 5.0
Logd 3.083
Compound Name Meliternin
Prediction Hob Swissadme 0.0
Exact Mass 386.1
Formal Charge 0.0
Monoisotopic Mass 386.1
Hydrogen Bond Acceptor Count 8.0
Molecular Weight 386.4
Covalent Unit Count 1.0
Total Atom Stereocenter Count 0.0
Total Bond Stereocenter Count 0.0
Esol -3.909564342857144
Inchi InChI=1S/C20H18O8/c1-22-13-8-14(23-2)18(24-3)19-15(13)16(21)20(25-4)17(28-19)10-5-6-11-12(7-10)27-9-26-11/h5-8H,9H2,1-4H3
Smiles COC1=CC(=C(C2=C1C(=O)C(=C(O2)C3=CC4=C(C=C3)OCO4)OC)OC)OC
Nring 4.0
Defined Bond Stereocenter Count 0.0