Glycoside
GD102511
Name:
NoneFormula:
C20H21O6N5SSmiles:
COC(=O)c1cccc(NC(=S)Nc2ncnc3c2ccn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c1Aglycone:
COC(=O)c1cccc(NC(=S)Nc2ncnc3c2C=C[N]3)c1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.3 |
| AlogP: | 0.64 | Num_rotatable_bonds: | 5 |
| MolWt: | 459.48 | Num_heavy_atoms: | 32 |
| TPSA: | 150.99 | NumAromaticRings: | 3 |
Unique Aglycone
AD43389
Formula: C15H12O2N5S
Smiles:
COC(=O)c1cccc(NC(=S)Nc2ncnc3c2C=C[N]3)c1| HBA: | 7 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.07 |
| AlogP: | 2.29 | Num_rotatable_bonds: | 3 |
| MolWt: | 326.36 | Num_heavy_atoms: | 23 |
| TPSA: | 90.24 | NumAromaticRings: | 2 |
