Glycoside
GD124538
Name:
Oleandomycin DerivativeFormula:
C35H59O11NSmiles:
COC1CC(OC2C(C)C(=O)OC(C)C(C)C=C(C)C(=O)C3(CO3)CC(C)C(OC3OC(C)CC(N(C)C)C3O)C2C)OC(C)C1OAglycone:
CC1=CC(C)C(C)OC(=O)C(C)C(O)C(C)C(OC2OC(C)CC(N(C)C)C2O)C(C)CC2(CO2)C1=OSugarmoiety:
COC1CC(O)OC(C)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 4 |
| HBD: | 2 | FractionCSP3: | 0.89 |
| AlogP: | 2.86 | Num_rotatable_bonds: | 6 |
| MolWt: | 669.85 | Num_heavy_atoms: | 47 |
| TPSA: | 145.75 | NumAromaticRings: | 0 |
Unique Aglycone
AD50315
Formula: C28H47O8N
Smiles:
CC1=CC(C)C(C)OC(=O)C(C)C(O)C(C)C(OC2OC(C)CC(N(C)C)C2O)C(C)CC2(CO2)C1=O| HBA: | 9 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.86 |
| AlogP: | 2.32 | Num_rotatable_bonds: | 3 |
| MolWt: | 525.68 | Num_heavy_atoms: | 37 |
| TPSA: | 118.06 | NumAromaticRings: | 0 |
