Glycoside
GD022722
Name:
NoneFormula:
C13H14O6N2Smiles:
N#Cc1ccccc1NC(=O)C(O)C(O)C(O)C(O)C=OAglycone:
N#Cc1ccccc1NSugarmoiety:
O=CC(O)C(O)C(O)C(O)C(=O)OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 1 |
| HBD: | 5 | FractionCSP3: | 0.31 |
| AlogP: | -1.86 | Num_rotatable_bonds: | 6 |
| MolWt: | 294.26 | Num_heavy_atoms: | 21 |
| TPSA: | 150.88 | NumAromaticRings: | 1 |
Unique Aglycone
AD15370
Formula: C7H6N2
Smiles:
N#Cc1ccccc1N| HBA: | 2 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | 1.14 | Num_rotatable_bonds: | 0 |
| MolWt: | 118.14 | Num_heavy_atoms: | 9 |
| TPSA: | 49.81 | NumAromaticRings: | 1 |
