Glycoside

GD040249
Name:
TylosinFormula:
C46H77O17NSmiles:
CC[C@H]1OC(=O)C[C@H](O)[C@H](C)[C@H](O[C@H]2O[C@H](C)[C@H](O[C@@H]3C[C@](C)(O)[C@@H](O)[C@@H](C)O3)[C@H](N(C)C)[C@@H]2O)[C@H](CC=O)C[C@H](C)C(=O)C=CC(C)=C[C@@H]1CO[C@H]1O[C@H](C)[C@H](O)[C@H](OC)[C@@H]1OCAglycone:
CCC1OC(=O)CC(O)C(C)C(O)C(CC=O)CC(C)C(=O)C=CC(C)=CC1COSugarmoiety:
CC1OC(O)C(O)C(N(C)C)C1OC1CC(C)(O)C(O)C(C)O1.COC1C(O)OC(C)C(O)C1OCOther Identifiers
Properties
HBA: | 18 | RingCount: | 4 |
HBD: | 5 | FractionCSP3: | 0.85 |
AlogP: | 1.83 | Num_rotatable_bonds: | 13 |
MolWt: | 916.11 | Num_heavy_atoms: | 64 |
TPSA: | 238.67 | NumAromaticRings: | 0 |
Unique Aglycone
AD01623
Formula: C23H36O7
Smiles:
CCC1OC(=O)CC(O)C(C)C(O)C(CC=O)CC(C)C(=O)C=CC(C)=CC1COHBA: | 7 | RingCount: | 1 |
HBD: | 3 | FractionCSP3: | 0.7 |
AlogP: | 1.98 | Num_rotatable_bonds: | 4 |
MolWt: | 424.53 | Num_heavy_atoms: | 30 |
TPSA: | 121.13 | NumAromaticRings: | 0 |