Glycoside
GD036834
Name:
NoneFormula:
C17H24O6N2Smiles:
CCCCCCC#Cc1cn([C@@H]2O[C@H](CO)[C@H](O)[C@H]2O)c(=O)[nH]c1=OAglycone:
CCCCCCC#Cc1c[nH]c(=O)[nH]c1=OSugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.65 |
| AlogP: | -0.53 | Num_rotatable_bonds: | 6 |
| MolWt: | 352.39 | Num_heavy_atoms: | 25 |
| TPSA: | 124.78 | NumAromaticRings: | 1 |
Unique Aglycone
AD23229
Formula: C12H16O2N2
Smiles:
CCCCCCC#Cc1c[nH]c(=O)[nH]c1=O| HBA: | 4 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.5 |
| AlogP: | 1.39 | Num_rotatable_bonds: | 4 |
| MolWt: | 220.27 | Num_heavy_atoms: | 16 |
| TPSA: | 65.72 | NumAromaticRings: | 1 |
