Glycoside
GD095004
Name:
NoneFormula:
C20H26O8N4Smiles:
CC(=O)N1CC(=O)N(c2cccnc2)C[C@]12CCN(C(=O)C(=O)[C@H](O)[C@@H](O)[C@H](O)CO)C2Aglycone:
CC(=O)N1CC(=O)N(c2cccnc2)CC12CCNC2Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 12 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.55 |
| AlogP: | -3.11 | Num_rotatable_bonds: | 6 |
| MolWt: | 450.45 | Num_heavy_atoms: | 32 |
| TPSA: | 171.81 | NumAromaticRings: | 1 |
Unique Aglycone
AD40586
Formula: C14H18O2N4
Smiles:
CC(=O)N1CC(=O)N(c2cccnc2)CC12CCNC2| HBA: | 6 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.5 |
| AlogP: | 0.01 | Num_rotatable_bonds: | 1 |
| MolWt: | 274.32 | Num_heavy_atoms: | 20 |
| TPSA: | 65.54 | NumAromaticRings: | 1 |
