Glycoside
GD103073
Name:
NoneFormula:
C21H21O6N5SSmiles:
Cc1c(CC(=O)Nc2ncnc3c2[nH]c(=O)n3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)sc2ccccc12Aglycone:
Cc1c(CC(=O)Nc2ncnc3[nH]c(=O)[nH]c23)sc2ccccc12Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 5 |
| HBD: | 5 | FractionCSP3: | 0.33 |
| AlogP: | 0.44 | Num_rotatable_bonds: | 5 |
| MolWt: | 471.5 | Num_heavy_atoms: | 33 |
| TPSA: | 162.59 | NumAromaticRings: | 4 |
Unique Aglycone
AD43613
Formula: C16H13O2N5S
Smiles:
Cc1c(CC(=O)Nc2ncnc3[nH]c(=O)[nH]c23)sc2ccccc12| HBA: | 7 | RingCount: | 4 |
| HBD: | 3 | FractionCSP3: | 0.12 |
| AlogP: | 2.35 | Num_rotatable_bonds: | 3 |
| MolWt: | 339.38 | Num_heavy_atoms: | 24 |
| TPSA: | 103.53 | NumAromaticRings: | 4 |
