Glycoside
GD033491
Name:
NoneFormula:
C16H20O5N2Smiles:
C[C@@H]1O[C@H](CNC(=O)c2cc3ccccc3[nH]2)[C@H](O)[C@H](O)[C@H]1OAglycone:
CNC(=O)c1cc2ccccc2[nH]1Sugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.44 |
| AlogP: | -0.23 | Num_rotatable_bonds: | 3 |
| MolWt: | 320.35 | Num_heavy_atoms: | 23 |
| TPSA: | 114.81 | NumAromaticRings: | 2 |
Unique Aglycone
AD21376
Formula: C10H10ON2
Smiles:
CNC(=O)c1cc2ccccc2[nH]1| HBA: | 3 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.1 |
| AlogP: | 1.53 | Num_rotatable_bonds: | 1 |
| MolWt: | 174.2 | Num_heavy_atoms: | 13 |
| TPSA: | 44.89 | NumAromaticRings: | 2 |
