Glycoside
GD092743
Name:
NoneFormula:
C20H26O7N4Smiles:
COC(=O)c1ccc(-c2noc(C[C@@H]3O[C@H](CNC(=O)NC(C)C)[C@@H](O)[C@H]3O)n2)cc1Aglycone:
CNC(=O)NC(C)C.COC(=O)c1ccc(-c2noc(C)n2)cc1Sugarmoiety:
OC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.5 |
| AlogP: | 0.26 | Num_rotatable_bonds: | 7 |
| MolWt: | 434.45 | Num_heavy_atoms: | 31 |
| TPSA: | 156.04 | NumAromaticRings: | 2 |
Unique Aglycone
AD21840
Formula: C5H12ON2
Smiles:
CNC(=O)NC(C)C| HBA: | 3 | RingCount: | 0 |
| HBD: | 2 | FractionCSP3: | 0.8 |
| AlogP: | 0.32 | Num_rotatable_bonds: | 1 |
| MolWt: | 116.16 | Num_heavy_atoms: | 8 |
| TPSA: | 41.13 | NumAromaticRings: | 0 |
AD38940
Formula: C11H10O3N2
Smiles:
COC(=O)c1ccc(-c2noc(C)n2)cc1| HBA: | 5 | RingCount: | 2 |
| HBD: | 0 | FractionCSP3: | 0.18 |
| AlogP: | 1.83 | Num_rotatable_bonds: | 2 |
| MolWt: | 218.21 | Num_heavy_atoms: | 16 |
| TPSA: | 65.22 | NumAromaticRings: | 2 |
