Glycoside
GD128857
Name:
SibanomicinFormula:
C23H31O5N3Smiles:
CCC=C1CC2C=Nc3ccc(OC4OC(C)C(NC)C(C)(O)C4O)cc3C(=O)N2C1Aglycone:
CCC=C1CC2C=Nc3ccc(O)cc3C(=O)N2C1Sugarmoiety:
CNC1C(C)OC(O)C(O)C1(C)OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 4 |
| HBD: | 3 | FractionCSP3: | 0.57 |
| AlogP: | 1.78 | Num_rotatable_bonds: | 4 |
| MolWt: | 429.52 | Num_heavy_atoms: | 31 |
| TPSA: | 103.62 | NumAromaticRings: | 1 |
Unique Aglycone
AD52192
Formula: C15H16O2N2
Smiles:
CCC=C1CC2C=Nc3ccc(O)cc3C(=O)N2C1| HBA: | 4 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.33 |
| AlogP: | 2.66 | Num_rotatable_bonds: | 1 |
| MolWt: | 256.31 | Num_heavy_atoms: | 19 |
| TPSA: | 52.9 | NumAromaticRings: | 1 |
