Glycoside
GD082365
Name:
NoneFormula:
C16H21O6N5SSmiles:
COC(=O)CCNC(=S)Nc1ncnc2c1ccn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1OAglycone:
COC(=O)CCNC(=S)Nc1ncnc2c1C=C[N]2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.5 |
| AlogP: | -1.11 | Num_rotatable_bonds: | 6 |
| MolWt: | 411.44 | Num_heavy_atoms: | 28 |
| TPSA: | 150.99 | NumAromaticRings: | 2 |
Unique Aglycone
AD37009
Formula: C11H12O2N5S
Smiles:
COC(=O)CCNC(=S)Nc1ncnc2c1C=C[N]2| HBA: | 7 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.27 |
| AlogP: | 0.55 | Num_rotatable_bonds: | 4 |
| MolWt: | 278.32 | Num_heavy_atoms: | 19 |
| TPSA: | 90.24 | NumAromaticRings: | 1 |
