Aglycone
AD45095
Formula: C18H31O6N
Smiles:
C=CC(O)C(O)CC1CC2CC(O1)C(CCC1OC(CN)CC1O)O2| HBA: | 7 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.89 |
| AlogP: | -0.14 | Num_rotatable_bonds: | 8 |
| MolWt: | 357.45 | Num_heavy_atoms: | 25 |
| TPSA: | 114.4 | NumAromaticRings: | 0 |
