Glycoside
GD098652
Name:
NoneFormula:
C16H21O7N6BrSmiles:
CCOC(=O)CCNC(=O)Nc1ncnc2c1nc(Br)n2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1OAglycone:
CCOC(=O)CCNC(=O)Nc1ncnc2c1N=C(Br)[N]2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 13 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.56 |
| AlogP: | -0.73 | Num_rotatable_bonds: | 7 |
| MolWt: | 489.28 | Num_heavy_atoms: | 30 |
| TPSA: | 180.95 | NumAromaticRings: | 2 |
Unique Aglycone
AD41961
Formula: C11H12O3N6Br
Smiles:
CCOC(=O)CCNC(=O)Nc1ncnc2c1N=C(Br)[N]2| HBA: | 9 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.36 |
| AlogP: | 1.18 | Num_rotatable_bonds: | 5 |
| MolWt: | 356.16 | Num_heavy_atoms: | 21 |
| TPSA: | 119.67 | NumAromaticRings: | 1 |
