Glycoside
GD099242
Name:
NoneFormula:
C26H33O7N3Smiles:
C=C[C@@H]1CN2CC[C@H]1C[C@@H]2[C@@H](NC(=O)C(=O)[C@H](O)[C@@H](O)[C@@H](O)CO)c1ccnc2ccc(OC)cc12Aglycone:
C=CC1CN2CCC1CC2C(N)c1ccnc2ccc(OC)cc12Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 10 | RingCount: | 5 |
| HBD: | 5 | FractionCSP3: | 0.5 |
| AlogP: | -0.06 | Num_rotatable_bonds: | 10 |
| MolWt: | 499.56 | Num_heavy_atoms: | 36 |
| TPSA: | 152.45 | NumAromaticRings: | 2 |
Unique Aglycone
AD42218
Formula: C20H25ON3
Smiles:
C=CC1CN2CCC1CC2C(N)c1ccnc2ccc(OC)cc12| HBA: | 4 | RingCount: | 5 |
| HBD: | 2 | FractionCSP3: | 0.45 |
| AlogP: | 3.14 | Num_rotatable_bonds: | 4 |
| MolWt: | 323.44 | Num_heavy_atoms: | 24 |
| TPSA: | 51.38 | NumAromaticRings: | 2 |
