Glycoside
GD054934
Name:
NoneFormula:
C14H21O6N3Smiles:
O=C(C(=O)N1CCC(n2cccn2)CC1)[C@H](O)[C@H](O)[C@H](O)COAglycone:
c1cnn(C2CCNCC2)c1Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 9 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.64 |
| AlogP: | -2.31 | Num_rotatable_bonds: | 6 |
| MolWt: | 327.34 | Num_heavy_atoms: | 23 |
| TPSA: | 136.12 | NumAromaticRings: | 1 |
Unique Aglycone
AD27930
Formula: C8H13N3
Smiles:
c1cnn(C2CCNCC2)c1| HBA: | 3 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.62 |
| AlogP: | 0.81 | Num_rotatable_bonds: | 1 |
| MolWt: | 151.21 | Num_heavy_atoms: | 11 |
| TPSA: | 29.85 | NumAromaticRings: | 1 |
