Glycoside
GD090639
Name:
NoneFormula:
C15H18O5N5BrSmiles:
OC[C@H]1O[C@@H](n2c(Br)nc3c(N=C4CCOCC4)ncnc32)[C@H](O)[C@@H]1OAglycone:
BrC1=Nc2c(ncnc2N=C2CCOCC2)[N]1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 4 |
| HBD: | 3 | FractionCSP3: | 0.6 |
| AlogP: | 0.08 | Num_rotatable_bonds: | 3 |
| MolWt: | 428.24 | Num_heavy_atoms: | 26 |
| TPSA: | 135.11 | NumAromaticRings: | 2 |
Unique Aglycone
AD39440
Formula: C10H9ON5Br
Smiles:
BrC1=Nc2c(ncnc2N=C2CCOCC2)[N]1| HBA: | 6 | RingCount: | 3 |
| HBD: | 0 | FractionCSP3: | 0.4 |
| AlogP: | 1.99 | Num_rotatable_bonds: | 1 |
| MolWt: | 295.12 | Num_heavy_atoms: | 17 |
| TPSA: | 73.83 | NumAromaticRings: | 1 |
