Glycoside
GD065168
Name:
NoneFormula:
C15H21O7N3Smiles:
O=C(N[C@H]1[C@H](O)O[C@H](CO)[C@@H](O)[C@@H]1O)c1cc(OC2CCC2)ncn1Aglycone:
NC(=O)c1cc(OC2CCC2)ncn1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.67 |
| AlogP: | -2.06 | Num_rotatable_bonds: | 5 |
| MolWt: | 355.35 | Num_heavy_atoms: | 25 |
| TPSA: | 154.26 | NumAromaticRings: | 1 |
Unique Aglycone
AD31342
Formula: C9H11O2N3
Smiles:
NC(=O)c1cc(OC2CCC2)ncn1| HBA: | 5 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.44 |
| AlogP: | 0.51 | Num_rotatable_bonds: | 3 |
| MolWt: | 193.21 | Num_heavy_atoms: | 14 |
| TPSA: | 78.1 | NumAromaticRings: | 1 |
