Glycoside
GD078860
Name:
NoneFormula:
C20H27O7NSmiles:
CC1(C)CC(=O)C=C(Nc2ccc(O[C@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]3O)cc2)C1Aglycone:
CC1(C)CC(=O)C=C(Nc2ccc(O)cc2)C1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.55 |
| AlogP: | 0.55 | Num_rotatable_bonds: | 5 |
| MolWt: | 393.44 | Num_heavy_atoms: | 28 |
| TPSA: | 128.48 | NumAromaticRings: | 1 |
Unique Aglycone
AD36233
Formula: C14H17O2N
Smiles:
CC1(C)CC(=O)C=C(Nc2ccc(O)cc2)C1| HBA: | 3 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.36 |
| AlogP: | 3.08 | Num_rotatable_bonds: | 2 |
| MolWt: | 231.29 | Num_heavy_atoms: | 17 |
| TPSA: | 49.33 | NumAromaticRings: | 1 |
