Diosgenin

Structure Molecule image
Relationships Total Number of functionally related protein(s) : 299
Total Number of Articles : 168
PubChem 99474
Molecular Formula

C27H42O3

SMILES

C[C@@H]1CC[C@@]2([C@H]([C@H]3[C@@H](O2)C[C@@H]4[C@@]3(CC[C@H]5[C@H]4CC=C6[C@@]5(CC[C@@H](C6)O)C)C)C)OC1

InChI

InChI=1S/C27H42O3/c1-16-7-12-27(29-15-16)17(2)24-23(30-27)14-22-20-6-5-18-13-19(28)8-10-25(18,3)21(20)9-11-26(22,24)4/h5,16-17,19-24,28H,6-15H2,1-4H3/t16-,17+,19+,20-,21+,22+,23+,24+,25+,26+,27-/m1/s1

synonyms
  • DIOSGENIN
  • 512-04-9
  • Nitogenin
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Properties
Property Value
MW 414.6 g/mol
HBD 1
HBA 3
Rotatable Bond Count 0
Exact Mass 414.31339520 g/mol
Monoisotopic Mass 414.31339520 g/mol
Heavy Atom Count 30
Isotope Atom Count 0
Atom Stereo Count 11
Covalent Unit Count 1
Complexity 746
xlogp 5.7
Topological Polar Surface Area 38.7