Glycoside
GD101015
Name:
NoneFormula:
C25H34O7N2Smiles:
C[C@@H]1O[C@@H](OCCNC(=O)[C@H]2CC=C[C@H]3CCN(Cc4ccccc4)C(=O)[C@@H]23)[C@@H](O)[C@H](O)[C@@H]1OAglycone:
O=C(NCCO)C1CC=CC2CCN(Cc3ccccc3)C(=O)C21Sugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.6 |
| AlogP: | 0.19 | Num_rotatable_bonds: | 7 |
| MolWt: | 474.55 | Num_heavy_atoms: | 34 |
| TPSA: | 128.56 | NumAromaticRings: | 1 |
Unique Aglycone
AD42702
Formula: C19H24O3N2
Smiles:
O=C(NCCO)C1CC=CC2CCN(Cc3ccccc3)C(=O)C21| HBA: | 5 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.47 |
| AlogP: | 1.34 | Num_rotatable_bonds: | 5 |
| MolWt: | 328.41 | Num_heavy_atoms: | 24 |
| TPSA: | 69.64 | NumAromaticRings: | 1 |
