CHEBI:166892

Structure Molecule image
Relationships Total Number of functionally related protein(s) : 146
Total Number of Articles : 164
PubChem 139597845
Molecular Formula

C34H48O8

SMILES

CC[C@@H](C)[C@H]1[C@@H](C=C[C@]2(O1)C[C@@H]3C[C@H](O2)CC=C([C@H]([C@H](C=CC=C4CO[C@H]5[C@]4([C@@H](C=C([C@H]5O)C)C(=O)O3)O)C)O)C)C

InChI

InChI=1S/C34H48O8/c1-7-19(2)30-22(5)13-14-33(42-30)17-26-16-25(41-33)12-11-21(4)28(35)20(3)9-8-10-24-18-39-31-29(36)23(6)15-27(32(37)40-26)34(24,31)38/h8-11,13-15,19-20,22,25-31,35-36,38H,7,12,16-18H2,1-6H3/t19-,20+,22-,25-,26+,27+,28+,29-,30+,31-,33+,34+/m1/s1

synonyms
  • Aglycone
  • CHEBI:166892
  • NS00067308
Click to show/hide the synonyms
Properties
Property Value
MW 584.7 g/mol
HBD 3
HBA 8
Rotatable Bond Count 2
Exact Mass 584.33491849 g/mol
Monoisotopic Mass 584.33491849 g/mol
Heavy Atom Count 42
Isotope Atom Count 0
Atom Stereo Count 12
Covalent Unit Count 1
Complexity 1180
xlogp 3
Topological Polar Surface Area 115