Glycoside
GD077012
Name:
NoneFormula:
C17H22O7N4Smiles:
COCOc1ccccc1Nc1c(C(N)=O)ncn1[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1OAglycone:
COCOc1ccccc1NC1=C(C(N)=O)N=C[N]1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.41 |
| AlogP: | -0.68 | Num_rotatable_bonds: | 8 |
| MolWt: | 394.38 | Num_heavy_atoms: | 28 |
| TPSA: | 161.32 | NumAromaticRings: | 2 |
Unique Aglycone
AD35366
Formula: C12H13O3N4
Smiles:
COCOc1ccccc1NC1=C(C(N)=O)N=C[N]1| HBA: | 7 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.17 |
| AlogP: | 0.38 | Num_rotatable_bonds: | 6 |
| MolWt: | 261.26 | Num_heavy_atoms: | 19 |
| TPSA: | 100.04 | NumAromaticRings: | 1 |
