Glycoside
GD066846
Name:
NoneFormula:
C15H17O7N3Smiles:
OC[C@H]1O[C@H](O)[C@H](n2cc(-c3ccc4c(c3)OCO4)nn2)[C@@H](O)[C@@H]1OAglycone:
C1=C(c2ccc3c(c2)OCO3)N=N[N]1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.47 |
| AlogP: | -1.35 | Num_rotatable_bonds: | 3 |
| MolWt: | 351.31 | Num_heavy_atoms: | 25 |
| TPSA: | 139.32 | NumAromaticRings: | 2 |
Unique Aglycone
AD31948
Formula: C9H6O2N3
Smiles:
C1=C(c2ccc3c(c2)OCO3)N=N[N]1| HBA: | 5 | RingCount: | 3 |
| HBD: | 0 | FractionCSP3: | 0.11 |
| AlogP: | 1.7 | Num_rotatable_bonds: | 1 |
| MolWt: | 188.17 | Num_heavy_atoms: | 14 |
| TPSA: | 57.28 | NumAromaticRings: | 1 |
