Glycoside
GD090513
Name:
NoneFormula:
C18H30O8N4Smiles:
C[C@@H]1O[C@@H](OCCNC(=O)c2cc(NC(=O)OC(C)(C)C)nn2C)[C@@H](O)[C@H](O)[C@@H]1OAglycone:
Cn1nc(NC(=O)OC(C)(C)C)cc1C(=O)NCCOSugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.72 |
| AlogP: | -0.66 | Num_rotatable_bonds: | 6 |
| MolWt: | 430.46 | Num_heavy_atoms: | 30 |
| TPSA: | 164.4 | NumAromaticRings: | 1 |
Unique Aglycone
AD39379
Formula: C12H20O4N4
Smiles:
Cn1nc(NC(=O)OC(C)(C)C)cc1C(=O)NCCO| HBA: | 8 | RingCount: | 1 |
| HBD: | 3 | FractionCSP3: | 0.58 |
| AlogP: | 0.49 | Num_rotatable_bonds: | 4 |
| MolWt: | 284.32 | Num_heavy_atoms: | 20 |
| TPSA: | 105.48 | NumAromaticRings: | 1 |
