monascin

Structure Molecule image
Relationships Total Number of functionally related protein(s) : 43
Total Number of Articles : 23
PubChem 12118082
Molecular Formula

C21H26O5

SMILES

CCCCCC(=O)[C@@H]1[C@H]2CC3=C(COC(=C3)/C=C/C)C(=O)[C@@]2(OC1=O)C

InChI

InChI=1S/C21H26O5/c1-4-6-7-9-17(22)18-16-11-13-10-14(8-5-2)25-12-15(13)19(23)21(16,3)26-20(18)24/h5,8,10,16,18H,4,6-7,9,11-12H2,1-3H3/b8-5+/t16-,18+,21-/m1/s1

synonyms
  • Monascin
  • 21516-68-7
  • Monascoflavin
Click to show/hide the synonyms
Properties
Property Value
MW 358.4 g/mol
HBD 0
HBA 5
Rotatable Bond Count 6
Exact Mass 358.17802393 g/mol
Monoisotopic Mass 358.17802393 g/mol
Heavy Atom Count 26
Isotope Atom Count 0
Atom Stereo Count 3
Covalent Unit Count 1
Complexity 727
xlogp 3.2
Topological Polar Surface Area 69.7