Glycoside
GD025462
Name:
NoneFormula:
C17H23O3N5SSmiles:
CCCCC#Cc1nc(N)c2ncn([C@@H]3O[C@H](CSC)[C@H](O)C3O)c2n1Aglycone:
CCCCC#Cc1nc(N)c2c(n1)[N]C=N2Sugarmoiety:
CSCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.59 |
| AlogP: | 0.93 | Num_rotatable_bonds: | 5 |
| MolWt: | 377.47 | Num_heavy_atoms: | 26 |
| TPSA: | 119.31 | NumAromaticRings: | 2 |
Unique Aglycone
AD02797
Formula: C11H12N5
Smiles:
CCCCC#Cc1nc(N)c2c(n1)[N]C=N2| HBA: | 5 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.36 |
| AlogP: | 1.51 | Num_rotatable_bonds: | 2 |
| MolWt: | 214.25 | Num_heavy_atoms: | 16 |
| TPSA: | 78.26 | NumAromaticRings: | 1 |
