Glycoside
GD078711
Name:
NoneFormula:
C20H33O5N2Smiles:
C[C@@H]1O[C@@H](OCC[NH2+][C@@H]2C[C@H](C)N(Cc3ccccc3)C2)[C@@H](O)[C@H](O)[C@@H]1OAglycone:
CC1CC([NH2+]CCO)CN1Cc1ccccc1Sugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.7 |
| AlogP: | -0.94 | Num_rotatable_bonds: | 7 |
| MolWt: | 381.49 | Num_heavy_atoms: | 27 |
| TPSA: | 99.0 | NumAromaticRings: | 1 |
Unique Aglycone
AD36176
Formula: C14H23ON2
Smiles:
CC1CC([NH2+]CCO)CN1Cc1ccccc1| HBA: | 3 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.57 |
| AlogP: | 0.21 | Num_rotatable_bonds: | 5 |
| MolWt: | 235.35 | Num_heavy_atoms: | 17 |
| TPSA: | 40.08 | NumAromaticRings: | 1 |
