acteoside

Structure Molecule image
Relationships Total Number of functionally related protein(s) : 229
Total Number of Articles : 118
PubChem 5281800
Molecular Formula

C29H36O15

SMILES

C[C@H]1[C@@H]([C@H]([C@H]([C@@H](O1)O[C@@H]2[C@H]([C@@H](O[C@@H]([C@H]2OC(=O)/C=C/C3=CC(=C(C=C3)O)O)CO)OCCC4=CC(=C(C=C4)O)O)O)O)O)O

InChI

InChI=1S/C29H36O15/c1-13-22(36)23(37)24(38)29(41-13)44-27-25(39)28(40-9-8-15-3-6-17(32)19(34)11-15)42-20(12-30)26(27)43-21(35)7-4-14-2-5-16(31)18(33)10-14/h2-7,10-11,13,20,22-34,36-39H,8-9,12H2,1H3/b7-4+/t13-,20+,22-,23+,24+,25+,26+,27+,28+,29-/m0/s1

synonyms
  • Verbascoside
  • Acteoside
  • 61276-17-3
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Properties
Property Value
MW 624.6 g/mol
HBD 9
HBA 15
Rotatable Bond Count 11
Exact Mass 624.20542044 g/mol
Monoisotopic Mass 624.20542044 g/mol
Heavy Atom Count 44
Isotope Atom Count 0
Atom Stereo Count 10
Covalent Unit Count 1
Complexity 936
xlogp -0.5
Topological Polar Surface Area 245