Glycoside
GD000544
Name:
OLEANDOMYCINFormula:
C35H61O12NSmiles:
CO[C@@H]1C[C@H](O[C@@H]2[C@H](C)C(=O)O[C@H](C)[C@H](C)[C@H](O)[C@H](C)C(=O)[C@]3(CO3)C[C@H](C)[C@H](O[C@@H]3O[C@H](C)C[C@H](N(C)C)[C@H]3O)[C@H]2C)O[C@H](C)[C@H]1OAglycone:
CC1CC(N(C)C)C(O)C(OC2C(C)CC3(CO3)C(=O)C(C)C(O)C(C)C(C)OC(=O)C(C)C(O)C2C)O1Sugarmoiety:
COC1CC(O)OC(C)C1OOther Identifiers
Properties
| HBA: | 13 | RingCount: | 4 |
| HBD: | 3 | FractionCSP3: | 0.94 |
| AlogP: | 1.91 | Num_rotatable_bonds: | 6 |
| MolWt: | 687.87 | Num_heavy_atoms: | 48 |
| TPSA: | 165.98 | NumAromaticRings: | 0 |
Unique Aglycone
AD00597
Formula: C28H49O9N
Smiles:
CC1CC(N(C)C)C(O)C(OC2C(C)CC3(CO3)C(=O)C(C)C(O)C(C)C(C)OC(=O)C(C)C(O)C2C)O1| HBA: | 10 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.93 |
| AlogP: | 1.37 | Num_rotatable_bonds: | 3 |
| MolWt: | 543.7 | Num_heavy_atoms: | 38 |
| TPSA: | 138.29 | NumAromaticRings: | 0 |
