Glycoside
GD143230
Name:
Terrein GlucosideFormula:
C14H20O8Smiles:
CC=CC1=CC(=O)C(OC2OC(CO)C(O)C(O)C2O)C1OAglycone:
CC=CC1=CC(=O)C(O)C1OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.64 |
| AlogP: | -2.38 | Num_rotatable_bonds: | 4 |
| MolWt: | 316.31 | Num_heavy_atoms: | 22 |
| TPSA: | 136.68 | NumAromaticRings: | 0 |
Unique Aglycone
AD57615
Formula: C8H10O3
Smiles:
CC=CC1=CC(=O)C(O)C1O| HBA: | 3 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.38 |
| AlogP: | -0.21 | Num_rotatable_bonds: | 1 |
| MolWt: | 154.16 | Num_heavy_atoms: | 11 |
| TPSA: | 57.53 | NumAromaticRings: | 0 |
