Glycoside
GD019271
Name:
NoneFormula:
C17H20O6N2Smiles:
CCCCC#Cc1cc2cn([C@@H]3O[C@H](CO)[C@H](O)[C@H]3O)c(=O)nc2o1Aglycone:
CCCCC#Cc1cc2c[nH]c(=O)nc2o1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.53 |
| AlogP: | 0.14 | Num_rotatable_bonds: | 4 |
| MolWt: | 348.36 | Num_heavy_atoms: | 25 |
| TPSA: | 117.95 | NumAromaticRings: | 2 |
Unique Aglycone
AD13476
Formula: C12H12O2N2
Smiles:
CCCCC#Cc1cc2c[nH]c(=O)nc2o1| HBA: | 4 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.33 |
| AlogP: | 2.06 | Num_rotatable_bonds: | 2 |
| MolWt: | 216.24 | Num_heavy_atoms: | 16 |
| TPSA: | 58.89 | NumAromaticRings: | 2 |
