1,2-dihydroxy-epoxy-1,2,3,4-tetrahydro-5-methylchrysene

Structure Molecule image
Relationships Total Number of functionally related protein(s) : 8
Total Number of Articles : 4
PubChem 57139
Molecular Formula

C19H16O3

SMILES

CC1=CC2=CC=CC=C2C3=C1C4=C(C=C3)[C@@H]([C@H]([C@@H]5[C@H]4O5)O)O

InChI

InChI=1S/C19H16O3/c1-9-8-10-4-2-3-5-11(10)12-6-7-13-15(14(9)12)18-19(22-18)17(21)16(13)20/h2-8,16-21H,1H3/t16-,17+,18-,19+/m0/s1

synonyms
  • 5-Methylchrysene-1S,2R-diol-3R,4S-epoxide
  • 81851-68-5
  • 111901-40-7
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Properties
Property Value
MW 292.3 g/mol
HBD 2
HBA 3
Rotatable Bond Count 0
Exact Mass 292.109944368 g/mol
Monoisotopic Mass 292.109944368 g/mol
Heavy Atom Count 22
Isotope Atom Count 0
Atom Stereo Count 4
Covalent Unit Count 1
Complexity 452
xlogp 2.6
Topological Polar Surface Area 53