Glycoside
GD035263
Name:
NoneFormula:
C17H24O7N2Smiles:
CCCCCC#Cc1cn([C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)c(=O)[nH]c1=OAglycone:
CCCCCC#Cc1c[nH]c(=O)[nH]c1=OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.65 |
| AlogP: | -1.56 | Num_rotatable_bonds: | 5 |
| MolWt: | 368.39 | Num_heavy_atoms: | 26 |
| TPSA: | 145.01 | NumAromaticRings: | 1 |
Unique Aglycone
AD09929
Formula: C11H14O2N2
Smiles:
CCCCCC#Cc1c[nH]c(=O)[nH]c1=O| HBA: | 4 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.45 |
| AlogP: | 0.99 | Num_rotatable_bonds: | 3 |
| MolWt: | 206.24 | Num_heavy_atoms: | 15 |
| TPSA: | 65.72 | NumAromaticRings: | 1 |
