Glycoside
GD073305
Name:
NoneFormula:
C18H26O8N2Smiles:
COCCn1c2c(ccc1=O)C[C@H](NC(=O)C(=O)[C@H](O)[C@@H](O)[C@@H](O)CO)CC2Aglycone:
COCCn1c2c(ccc1=O)CC(N)CC2Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 10 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.61 |
| AlogP: | -2.89 | Num_rotatable_bonds: | 9 |
| MolWt: | 398.41 | Num_heavy_atoms: | 28 |
| TPSA: | 158.32 | NumAromaticRings: | 1 |
Unique Aglycone
AD34011
Formula: C12H18O2N2
Smiles:
COCCn1c2c(ccc1=O)CC(N)CC2| HBA: | 4 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.58 |
| AlogP: | 0.31 | Num_rotatable_bonds: | 3 |
| MolWt: | 222.29 | Num_heavy_atoms: | 16 |
| TPSA: | 57.25 | NumAromaticRings: | 1 |
