Glycoside
GD088741
Name:
NoneFormula:
C18H26O5N6SSmiles:
OC[C@H]1O[C@@H](n2ccc3c(NC(=S)NCCN4CCOCC4)ncnc32)[C@H](O)[C@@H]1OAglycone:
S=C(NCCN1CCOCC1)Nc1ncnc2c1C=C[N]2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.61 |
| AlogP: | -1.34 | Num_rotatable_bonds: | 6 |
| MolWt: | 438.51 | Num_heavy_atoms: | 30 |
| TPSA: | 137.16 | NumAromaticRings: | 2 |
Unique Aglycone
AD38825
Formula: C13H17ON6S
Smiles:
S=C(NCCN1CCOCC1)Nc1ncnc2c1C=C[N]2| HBA: | 7 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.46 |
| AlogP: | 0.32 | Num_rotatable_bonds: | 4 |
| MolWt: | 305.39 | Num_heavy_atoms: | 21 |
| TPSA: | 76.41 | NumAromaticRings: | 1 |
