3',4'-Dihydroxyetoposide

Structure Molecule image
Relationships Total Number of functionally related protein(s) : 2
Total Number of Articles : 3
PubChem 127462
Molecular Formula

C28H30O13

SMILES

C[C@@H]1OC[C@@H]2[C@@H](O1)[C@@H]([C@H]([C@@H](O2)O[C@H]3[C@H]4COC(=O)[C@@H]4[C@@H](C5=CC6=C(C=C35)OCO6)C7=CC(=C(C(=C7)OC)O)O)O)O

InChI

InChI=1S/C28H30O13/c1-10-35-8-19-26(39-10)23(31)24(32)28(40-19)41-25-13-6-17-16(37-9-38-17)5-12(13)20(21-14(25)7-36-27(21)33)11-3-15(29)22(30)18(4-11)34-2/h3-6,10,14,19-21,23-26,28-32H,7-9H2,1-2H3/t10-,14+,19-,20-,21+,23-,24-,25-,26-,28+/m1/s1

synonyms
  • 3',4'-Dihydroxyetoposide
  • 100007-54-3
  • Etoposide catechol
Click to show/hide the synonyms
Properties
Property Value
MW 574.5 g/mol
HBD 4
HBA 13
Rotatable Bond Count 4
Exact Mass 574.16864101 g/mol
Monoisotopic Mass 574.16864101 g/mol
Heavy Atom Count 41
Isotope Atom Count 0
Atom Stereo Count 10
Covalent Unit Count 1
Complexity 967
xlogp 0.3
Topological Polar Surface Area 172