Glycoside
GD097399
Name:
NoneFormula:
C20H31O9N3Smiles:
C[C@@H]1O[C@@H](OCCNC(=O)c2noc3c2CN(C(=O)OC(C)(C)C)CC3)[C@@H](O)[C@H](O)[C@@H]1OAglycone:
CC(C)(C)OC(=O)N1CCc2onc(C(=O)NCCO)c2C1Sugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.75 |
| AlogP: | -0.46 | Num_rotatable_bonds: | 5 |
| MolWt: | 457.48 | Num_heavy_atoms: | 32 |
| TPSA: | 163.82 | NumAromaticRings: | 1 |
Unique Aglycone
AD41416
Formula: C14H21O5N3
Smiles:
CC(C)(C)OC(=O)N1CCc2onc(C(=O)NCCO)c2C1| HBA: | 8 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.64 |
| AlogP: | 0.69 | Num_rotatable_bonds: | 3 |
| MolWt: | 311.34 | Num_heavy_atoms: | 22 |
| TPSA: | 104.9 | NumAromaticRings: | 1 |
