24-hydroxyursolic acid

Structure Molecule image
Relationships Total Number of functionally related protein(s) : 4
Total Number of Articles : 1
PubChem 44568920
Molecular Formula

C30H48O4

SMILES

C[C@@H]1CC[C@@]2(CC[C@@]3(C(=CC[C@H]4[C@]3(CC[C@@H]5[C@@]4(CC[C@@H]([C@]5(C)CO)O)C)C)[C@@H]2[C@H]1C)C)C(=O)O

InChI

InChI=1S/C30H48O4/c1-18-9-14-30(25(33)34)16-15-28(5)20(24(30)19(18)2)7-8-22-26(3)12-11-23(32)27(4,17-31)21(26)10-13-29(22,28)6/h7,18-19,21-24,31-32H,8-17H2,1-6H3,(H,33,34)/t18-,19+,21-,22-,23+,24+,26+,27-,28-,29-,30+/m1/s1

synonyms
  • 24-hydroxyursolic acid
  • CHEMBL522373
  • BDBM50253075
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Properties
Property Value
MW 472.7 g/mol
HBD 3
HBA 4
Rotatable Bond Count 2
Exact Mass 472.35526001 g/mol
Monoisotopic Mass 472.35526001 g/mol
Heavy Atom Count 34
Isotope Atom Count 0
Atom Stereo Count 11
Covalent Unit Count 1
Complexity 896
xlogp 6.7
Topological Polar Surface Area 77.8