Glycoside
GD084935
Name:
NoneFormula:
C21H34O6N3Smiles:
CC[NH+]1CCN(c2ccc(C(=O)NCCO[C@@H]3O[C@@H](C)[C@@H](O)[C@@H](O)[C@@H]3O)cc2)CC1Aglycone:
CC[NH+]1CCN(c2ccc(C(=O)NCCO)cc2)CC1Sugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.67 |
| AlogP: | -2.01 | Num_rotatable_bonds: | 7 |
| MolWt: | 424.52 | Num_heavy_atoms: | 30 |
| TPSA: | 115.93 | NumAromaticRings: | 1 |
Unique Aglycone
AD38010
Formula: C15H24O2N3
Smiles:
CC[NH+]1CCN(c2ccc(C(=O)NCCO)cc2)CC1| HBA: | 5 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.53 |
| AlogP: | -0.87 | Num_rotatable_bonds: | 5 |
| MolWt: | 278.38 | Num_heavy_atoms: | 20 |
| TPSA: | 57.01 | NumAromaticRings: | 1 |
