Glycoside
GD073083
Name:
NoneFormula:
C17H24O8N2Smiles:
COc1ccc(O[C@@H]2CCCN(C(=O)C(=O)[C@H](O)[C@H](O)[C@H](O)CO)C2)nc1Aglycone:
COc1ccc(OC2CCCNC2)nc1Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 10 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.59 |
| AlogP: | -1.9 | Num_rotatable_bonds: | 8 |
| MolWt: | 384.39 | Num_heavy_atoms: | 27 |
| TPSA: | 149.65 | NumAromaticRings: | 1 |
Unique Aglycone
AD33957
Formula: C11H16O2N2
Smiles:
COc1ccc(OC2CCCNC2)nc1| HBA: | 4 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.55 |
| AlogP: | 1.22 | Num_rotatable_bonds: | 3 |
| MolWt: | 208.26 | Num_heavy_atoms: | 15 |
| TPSA: | 43.38 | NumAromaticRings: | 1 |
