Glycoside
GD014942
Name:
NoneFormula:
C26H36O9N4Smiles:
C[C@H](NC(=O)OC(C)(C)C)C(=O)N1Cc2[nH]c3ccccc3c2C[C@H]1C(=O)N[C@@H]1C(O)O[C@H](CO)[C@H](O)[C@H]1OAglycone:
CC(NC(=O)OC(C)(C)C)C(=O)N1Cc2[nH]c3ccccc3c2CC1C(N)=OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 13 | RingCount: | 4 |
| HBD: | 7 | FractionCSP3: | 0.58 |
| AlogP: | -0.75 | Num_rotatable_bonds: | 5 |
| MolWt: | 548.59 | Num_heavy_atoms: | 39 |
| TPSA: | 193.68 | NumAromaticRings: | 2 |
Unique Aglycone
AD07328
Formula: C20H26O4N4
Smiles:
CC(NC(=O)OC(C)(C)C)C(=O)N1Cc2[nH]c3ccccc3c2CC1C(N)=O| HBA: | 8 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.45 |
| AlogP: | 1.82 | Num_rotatable_bonds: | 3 |
| MolWt: | 386.45 | Num_heavy_atoms: | 28 |
| TPSA: | 117.52 | NumAromaticRings: | 2 |
