stevioside

Structure Molecule image
Relationships Total Number of functionally related protein(s) : 121
Total Number of Articles : 69
PubChem 442089
Molecular Formula

C38H60O18

SMILES

C[C@@]12CCC[C@@]([C@H]1CC[C@]34[C@H]2CC[C@](C3)(C(=C)C4)O[C@H]5[C@@H]([C@H]([C@@H]([C@H](O5)CO)O)O)O[C@H]6[C@@H]([C@H]([C@@H]([C@H](O6)CO)O)O)O)(C)C(=O)O[C@H]7[C@@H]([C@H]([C@@H]([C@H](O7)CO)O)O)O

InChI

InChI=1S/C38H60O18/c1-16-11-37-9-5-20-35(2,7-4-8-36(20,3)34(50)55-32-29(49)26(46)23(43)18(13-40)52-32)21(37)6-10-38(16,15-37)56-33-30(27(47)24(44)19(14-41)53-33)54-31-28(48)25(45)22(42)17(12-39)51-31/h17-33,39-49H,1,4-15H2,2-3H3/t17-,18-,19-,20+,21+,22-,23-,24-,25+,26+,27+,28-,29-,30-,31+,32+,33+,35-,36-,37-,38+/m1/s1

synonyms
  • Stevioside
  • Steviosin
  • 57817-89-7
Click to show/hide the synonyms
Properties
Property Value
MW 804.9 g/mol
HBD 11
HBA 18
Rotatable Bond Count 10
Exact Mass 804.37796506 g/mol
Monoisotopic Mass 804.37796506 g/mol
Heavy Atom Count 56
Isotope Atom Count 0
Atom Stereo Count 21
Covalent Unit Count 1
Complexity 1450
xlogp -1.2
Topological Polar Surface Area 295