Glycoside
GD062384
Name:
NoneFormula:
C10H11O6N4BrSmiles:
O=c1[nH]c(=O)c2nc(Br)n([C@H]3O[C@H](CO)[C@@H](O)[C@@H]3O)c2[nH]1Aglycone:
O=c1[nH]c2c(c(=O)[nH]1)N=C(Br)[N]2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.5 |
| AlogP: | -2.21 | Num_rotatable_bonds: | 2 |
| MolWt: | 363.12 | Num_heavy_atoms: | 21 |
| TPSA: | 153.46 | NumAromaticRings: | 2 |
Unique Aglycone
AD03726
Formula: C5H2O2N4Br
Smiles:
O=c1[nH]c2c(c(=O)[nH]1)N=C(Br)[N]2| HBA: | 6 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | -0.3 | Num_rotatable_bonds: | 0 |
| MolWt: | 230.0 | Num_heavy_atoms: | 12 |
| TPSA: | 92.18 | NumAromaticRings: | 1 |
