Glycoside
GD081657
Name:
NoneFormula:
C19H28O8N2Smiles:
COCCOc1cccc(N2CCN(C(=O)C(=O)[C@H](O)[C@@H](O)[C@H](O)CO)CC2)c1Aglycone:
COCCOc1cccc(N2CCNCC2)c1Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 10 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.58 |
| AlogP: | -2.0 | Num_rotatable_bonds: | 10 |
| MolWt: | 412.44 | Num_heavy_atoms: | 29 |
| TPSA: | 140.0 | NumAromaticRings: | 1 |
Unique Aglycone
AD36725
Formula: C13H20O2N2
Smiles:
COCCOc1cccc(N2CCNCC2)c1| HBA: | 4 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.54 |
| AlogP: | 1.12 | Num_rotatable_bonds: | 5 |
| MolWt: | 236.31 | Num_heavy_atoms: | 17 |
| TPSA: | 33.73 | NumAromaticRings: | 1 |
