Glycoside
GD128478
Name:
Steffimycin CFormula:
C29H34O15Smiles:
COc1cc(O)c2c(c1)C(=O)c1c(O)c3c(c(O)c1C2=O)C(OC1OC(C)C(OC)C(O)C1OC)C(OC)C(C)(O)C3(O)OAglycone:
COc1cc(O)c2c(c1)C(=O)c1c(O)c3c(c(O)c1C2=O)C(O)C(OC)C(C)(O)C3(O)OSugarmoiety:
COC1C(C)OC(O)C(OC)C1OOther Identifiers
Properties
| HBA: | 15 | RingCount: | 5 |
| HBD: | 7 | FractionCSP3: | 0.52 |
| AlogP: | -0.3 | Num_rotatable_bonds: | 6 |
| MolWt: | 622.58 | Num_heavy_atoms: | 44 |
| TPSA: | 231.13 | NumAromaticRings: | 2 |
Unique Aglycone
AD52041
Formula: C21H20O11
Smiles:
COc1cc(O)c2c(c1)C(=O)c1c(O)c3c(c(O)c1C2=O)C(O)C(OC)C(C)(O)C3(O)O| HBA: | 11 | RingCount: | 4 |
| HBD: | 7 | FractionCSP3: | 0.33 |
| AlogP: | -0.46 | Num_rotatable_bonds: | 2 |
| MolWt: | 448.38 | Num_heavy_atoms: | 32 |
| TPSA: | 194.21 | NumAromaticRings: | 2 |
