Glycoside
GD057284
Name:
NoneFormula:
C15H19O6N3Smiles:
OC[C@H]1O[C@@H](O)[C@H](n2cc(COc3ccccc3)nn2)[C@@H](O)[C@@H]1OAglycone:
C1=C(COc2ccccc2)N=N[N]1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.47 |
| AlogP: | -1.17 | Num_rotatable_bonds: | 5 |
| MolWt: | 337.33 | Num_heavy_atoms: | 24 |
| TPSA: | 130.09 | NumAromaticRings: | 2 |
Unique Aglycone
AD21100
Formula: C9H8ON3
Smiles:
C1=C(COc2ccccc2)N=N[N]1| HBA: | 4 | RingCount: | 2 |
| HBD: | 0 | FractionCSP3: | 0.11 |
| AlogP: | 1.89 | Num_rotatable_bonds: | 3 |
| MolWt: | 174.18 | Num_heavy_atoms: | 13 |
| TPSA: | 48.05 | NumAromaticRings: | 1 |
