Glycoside
GD125874
Name:
Inosamycin AFormula:
C23H45O14N5Smiles:
NCC1OC(OC2C(CO)OC(OC3C(O)C(O)CC(N)C3OC3OC(CN)C(O)C(O)C3N)C2O)C(N)C(O)C1OAglycone:
NC1CC(O)C(O)C(O)C1OSugarmoiety:
NCC1OC(O)C(N)C(O)C1O.NCC1OC(OC2C(CO)OC(O)C2O)C(N)C(O)C1OOther Identifiers
Properties
| HBA: | 19 | RingCount: | 4 |
| HBD: | 18 | FractionCSP3: | 1.0 |
| AlogP: | -8.86 | Num_rotatable_bonds: | 9 |
| MolWt: | 615.63 | Num_heavy_atoms: | 42 |
| TPSA: | 347.32 | NumAromaticRings: | 0 |
Unique Aglycone
AD17359
Formula: C6H13O4N
Smiles:
NC1CC(O)C(O)C(O)C1O| HBA: | 5 | RingCount: | 1 |
| HBD: | 6 | FractionCSP3: | 1.0 |
| AlogP: | -2.84 | Num_rotatable_bonds: | 0 |
| MolWt: | 163.17 | Num_heavy_atoms: | 11 |
| TPSA: | 106.94 | NumAromaticRings: | 0 |
