Glycoside
GD114458
Name:
8-DemethoxysteffimycinFormula:
C28H32O10Smiles:
COc1cc(O)c2c(c1)C(=O)c1cc3c(c(C)c1C2=O)C(OC1OC(C)C(O)C(O)C1OC)CC(C)(O)C3Aglycone:
COc1cc(O)c2c(c1)C(=O)c1cc3c(c(C)c1C2=O)C(O)CC(C)(O)C3Sugarmoiety:
COC1C(O)OC(C)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 5 |
| HBD: | 4 | FractionCSP3: | 0.5 |
| AlogP: | 1.72 | Num_rotatable_bonds: | 4 |
| MolWt: | 528.55 | Num_heavy_atoms: | 38 |
| TPSA: | 151.98 | NumAromaticRings: | 2 |
Unique Aglycone
AD45071
Formula: C21H20O6
Smiles:
COc1cc(O)c2c(c1)C(=O)c1cc3c(c(C)c1C2=O)C(O)CC(C)(O)C3| HBA: | 6 | RingCount: | 4 |
| HBD: | 3 | FractionCSP3: | 0.33 |
| AlogP: | 2.22 | Num_rotatable_bonds: | 1 |
| MolWt: | 368.39 | Num_heavy_atoms: | 27 |
| TPSA: | 104.06 | NumAromaticRings: | 2 |
