Glycoside
GD037432
Name:
NoneFormula:
C18H23O8N3Smiles:
COC(=O)c1cccc(-n2cc(CO[C@H]3[C@H](O)[C@@H](OC)O[C@@H](CO)[C@H]3O)nn2)c1Aglycone:
COC(=O)c1cccc(-n2cc(CO)nn2)c1Sugarmoiety:
COC1OC(CO)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.5 |
| AlogP: | -0.98 | Num_rotatable_bonds: | 7 |
| MolWt: | 409.4 | Num_heavy_atoms: | 29 |
| TPSA: | 145.39 | NumAromaticRings: | 2 |
Unique Aglycone
AD22154
Formula: C11H11O3N3
Smiles:
COC(=O)c1cccc(-n2cc(CO)nn2)c1| HBA: | 6 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.18 |
| AlogP: | 0.55 | Num_rotatable_bonds: | 3 |
| MolWt: | 233.23 | Num_heavy_atoms: | 17 |
| TPSA: | 77.24 | NumAromaticRings: | 2 |
