okundoperoxide

Structure Molecule image
Relationships Total Number of functionally related protein(s) : 1
Total Number of Articles : 1
PubChem 25227596
Molecular Formula

C15H22O4

SMILES

C/C(=C\CO)/[C@H]1C[C@@H]2[C@](C=CC(=O)C2(C)C)(OO1)C

InChI

InChI=1S/C15H22O4/c1-10(6-8-16)11-9-12-14(2,3)13(17)5-7-15(12,4)19-18-11/h5-7,11-12,16H,8-9H2,1-4H3/b10-6+/t11-,12+,15+/m1/s1

synonyms
  • Okundoperoxide
  • (3R,4aS,8aS)-3-[(E)-4-hydroxybut-2-en-2-yl]-5,5,8a-trimethyl-4,4a-dihydro-3H-1,2-benzodioxin-6-one
  • (3R,4aS,8aS)-3-((E)-4-hydroxybut-2-en-2-yl)-5,5,8a-trimethyl-4,4a-dihydro-3H-1,2-benzodioxin-6-one
Click to show/hide the synonyms
Properties
Property Value
MW 266.33 g/mol
HBD 1
HBA 4
Rotatable Bond Count 2
Exact Mass 266.15180918 g/mol
Monoisotopic Mass 266.15180918 g/mol
Heavy Atom Count 19
Isotope Atom Count 0
Atom Stereo Count 3
Covalent Unit Count 1
Complexity 435
xlogp 1.8
Topological Polar Surface Area 55.8