arjunic acid

Structure Molecule image
Relationships Total Number of functionally related protein(s) : 17
Total Number of Articles : 4
PubChem 15385516
Molecular Formula

C30H48O5

SMILES

C[C@@]12CC[C@@H]3[C@@]([C@H]1CC=C4[C@]2(CC[C@@]5([C@H]4[C@@H](C(CC5)(C)C)O)C(=O)O)C)(C[C@H]([C@@H](C3(C)C)O)O)C

InChI

InChI=1S/C30H48O5/c1-25(2)12-14-30(24(34)35)15-13-28(6)17(21(30)23(25)33)8-9-20-27(5)16-18(31)22(32)26(3,4)19(27)10-11-29(20,28)7/h8,18-23,31-33H,9-16H2,1-7H3,(H,34,35)/t18-,19+,20-,21-,22+,23+,27+,28-,29-,30+/m1/s1

synonyms
  • Arjunic acid
  • 31298-06-3
  • Arjuntriterpenic acid
Click to show/hide the synonyms
Properties
Property Value
MW 488.7 g/mol
HBD 4
HBA 5
Rotatable Bond Count 1
Exact Mass 488.35017463 g/mol
Monoisotopic Mass 488.35017463 g/mol
Heavy Atom Count 35
Isotope Atom Count 0
Atom Stereo Count 10
Covalent Unit Count 1
Complexity 952
xlogp 5.2
Topological Polar Surface Area 98