Glycoside
GD061873
Name:
NoneFormula:
C16H21O5N3Smiles:
N#Cc1c(N[C@H]2[C@H](O)O[C@H](CO)[C@@H](O)[C@@H]2O)ncc2c1CCCC2Aglycone:
N#Cc1c(N)ncc2c1CCCC2Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.62 |
| AlogP: | -0.96 | Num_rotatable_bonds: | 3 |
| MolWt: | 335.36 | Num_heavy_atoms: | 24 |
| TPSA: | 138.86 | NumAromaticRings: | 1 |
Unique Aglycone
AD30253
Formula: C10H11N3
Smiles:
N#Cc1c(N)ncc2c1CCCC2| HBA: | 3 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.4 |
| AlogP: | 1.41 | Num_rotatable_bonds: | 0 |
| MolWt: | 173.22 | Num_heavy_atoms: | 13 |
| TPSA: | 62.7 | NumAromaticRings: | 1 |
