Glycoside
GD037116
Name:
NoneFormula:
C18H16O6N2Br2Smiles:
OC[C@@H]1O[C@H](Oc2c(Br)cc(Br)c3nc4ccccc4nc23)[C@H](O)[C@H](O)[C@H]1OAglycone:
Oc1c(Br)cc(Br)c2nc3ccccc3nc12Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.33 |
| AlogP: | 1.49 | Num_rotatable_bonds: | 3 |
| MolWt: | 516.14 | Num_heavy_atoms: | 28 |
| TPSA: | 125.16 | NumAromaticRings: | 3 |
Unique Aglycone
AD23405
Formula: C12H6ON2Br2
Smiles:
Oc1c(Br)cc(Br)c2nc3ccccc3nc12| HBA: | 3 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.0 |
| AlogP: | 4.01 | Num_rotatable_bonds: | 0 |
| MolWt: | 354.0 | Num_heavy_atoms: | 17 |
| TPSA: | 46.01 | NumAromaticRings: | 3 |
