Glycoside
GD050830
Name:
NoneFormula:
C11H16O8N2Smiles:
CCOC(=O)[C@H](C#N)NC(=O)C(=O)[C@H](O)[C@@H](O)[C@H](O)COAglycone:
CCOC(=O)C(N)C#NSugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 10 | RingCount: | 0 |
| HBD: | 5 | FractionCSP3: | 0.64 |
| AlogP: | -3.8 | Num_rotatable_bonds: | 8 |
| MolWt: | 304.26 | Num_heavy_atoms: | 21 |
| TPSA: | 177.18 | NumAromaticRings: | 0 |
Unique Aglycone
AD26746
Formula: C5H8O2N2
Smiles:
CCOC(=O)C(N)C#N| HBA: | 4 | RingCount: | 0 |
| HBD: | 2 | FractionCSP3: | 0.6 |
| AlogP: | -0.6 | Num_rotatable_bonds: | 2 |
| MolWt: | 128.13 | Num_heavy_atoms: | 9 |
| TPSA: | 76.11 | NumAromaticRings: | 0 |
