Glycoside
GD089221
Name:
NoneFormula:
C20H27O6N5Smiles:
O=C1NC(=O)C2=Nc3ccc(N4CCCCC4)cc3N(C[C@H](O)[C@H](O)[C@H](O)CO)[C@@H]2N1Aglycone:
CN1c2cc(N3CCCCC3)ccc2N=C2C(=O)NC(=O)NC21Sugarmoiety:
OCC(O)C(O)C(O)OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 4 |
| HBD: | 6 | FractionCSP3: | 0.55 |
| AlogP: | -1.19 | Num_rotatable_bonds: | 6 |
| MolWt: | 433.47 | Num_heavy_atoms: | 31 |
| TPSA: | 157.96 | NumAromaticRings: | 1 |
Unique Aglycone
AD38292
Formula: C16H19O2N5
Smiles:
CN1c2cc(N3CCCCC3)ccc2N=C2C(=O)NC(=O)NC21| HBA: | 7 | RingCount: | 4 |
| HBD: | 2 | FractionCSP3: | 0.44 |
| AlogP: | 1.36 | Num_rotatable_bonds: | 1 |
| MolWt: | 313.36 | Num_heavy_atoms: | 23 |
| TPSA: | 77.04 | NumAromaticRings: | 1 |
