Glycoside
GD017316
Name:
NoneFormula:
C18H19O5N3Smiles:
OC[C@@H]1O[C@H](n2cc(-c3cccc4ccccc34)nn2)[C@H](O)[C@H](O)[C@H]1OAglycone:
C1=C(c2cccc3ccccc23)N=N[N]1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.33 |
| AlogP: | 0.07 | Num_rotatable_bonds: | 3 |
| MolWt: | 357.37 | Num_heavy_atoms: | 26 |
| TPSA: | 120.86 | NumAromaticRings: | 3 |
Unique Aglycone
AD04315
Formula: C12H8N3
Smiles:
C1=C(c2cccc3ccccc23)N=N[N]1| HBA: | 3 | RingCount: | 3 |
| HBD: | 0 | FractionCSP3: | 0.0 |
| AlogP: | 3.12 | Num_rotatable_bonds: | 1 |
| MolWt: | 194.22 | Num_heavy_atoms: | 15 |
| TPSA: | 38.82 | NumAromaticRings: | 2 |
