Glycoside
GD010877
Name:
NoneFormula:
C27H27O4NSmiles:
Cc1ccc(OCC2OC(C#N)C(Oc3ccc(C)cc3)C2Oc2ccc(C)cc2)cc1Aglycone:
COc1ccc(C)cc1.Cc1ccc(O)cc1.Cc1ccc(O)cc1Sugarmoiety:
N#CC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 5 | RingCount: | 4 |
| HBD: | 0 | FractionCSP3: | 0.3 |
| AlogP: | 5.18 | Num_rotatable_bonds: | 7 |
| MolWt: | 429.52 | Num_heavy_atoms: | 32 |
| TPSA: | 60.71 | NumAromaticRings: | 3 |
Unique Aglycone
AD00732
Formula: C7H8O
Smiles:
Cc1ccc(O)cc1| HBA: | 1 | RingCount: | 1 |
| HBD: | 1 | FractionCSP3: | 0.14 |
| AlogP: | 1.7 | Num_rotatable_bonds: | 0 |
| MolWt: | 108.14 | Num_heavy_atoms: | 8 |
| TPSA: | 20.23 | NumAromaticRings: | 1 |
AD01981
Formula: C8H10O
Smiles:
COc1ccc(C)cc1| HBA: | 1 | RingCount: | 1 |
| HBD: | 0 | FractionCSP3: | 0.25 |
| AlogP: | 2.0 | Num_rotatable_bonds: | 1 |
| MolWt: | 122.17 | Num_heavy_atoms: | 9 |
| TPSA: | 9.23 | NumAromaticRings: | 1 |
