Glycoside
GD075823
Name:
NoneFormula:
C19H29O6N2Smiles:
C[C@@H]1O[C@@H](OCCNC(=O)[C@@H]([NH3+])C2Cc3ccccc3C2)[C@@H](O)[C@H](O)[C@@H]1OAglycone:
[NH3+]C(C(=O)NCCO)C1Cc2ccccc2C1Sugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 3 |
| HBD: | 7 | FractionCSP3: | 0.63 |
| AlogP: | -2.03 | Num_rotatable_bonds: | 6 |
| MolWt: | 381.45 | Num_heavy_atoms: | 27 |
| TPSA: | 135.89 | NumAromaticRings: | 1 |
Unique Aglycone
AD35117
Formula: C13H19O2N2
Smiles:
[NH3+]C(C(=O)NCCO)C1Cc2ccccc2C1| HBA: | 4 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.46 |
| AlogP: | -0.88 | Num_rotatable_bonds: | 4 |
| MolWt: | 235.31 | Num_heavy_atoms: | 17 |
| TPSA: | 76.97 | NumAromaticRings: | 1 |
