829313 logo
O-ACETYLURSOLIC ACID
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
  • 3-Acetylursolic Acid
  • 3Beta-O-Acetylursolic Acid
  • O-Acetylursolic Acid
SMILES
CC(=O)O[C@H]1CC[C@@]2(C)[C@@H](CC[C@]3(C)[C@@H]2CC=C2[C@@H]4[C@@H](C)[C@H](C)CC[C@]4(C(=O)O)CC[C@]23C)C1(C)C
InChI
InChI=1S/C32H50O4/c1-19-11-16-32(27(34)35)18-17-30(7)22(26(32)20(19)2)9-10-24-29(6)14-13-25(36-21(3)33)28(4,5)23(29)12-15-31(24,30)8/h9,19-20,23-26H,10-18H2,1-8H3,(H,34,35)/t19-,20+,23+,24-,25+,26+,29+,30-,31-,32+/m1/s1
MOLECULAR FORMULA
C32H50O4
CROSS REFERENCES
829313 logo

O-ACETYLURSOLIC ACID

Compound Synopsis

OVERVIEW
PROPERTIES
Molecular weight 498.37
AlogP 7.66
HBond donors 1
HBond acceptors 4
Atoms 86
Contains toxicophore No
Contains PAINS No
Commercially available Unknown
Property color indications are based on Lipinski's Ro5.
PROTEIN TARGETS
No information about proteins targeted by O-ACETYLURSOLIC ACID.