Glycoside
GD142494
Name:
Satosporin AFormula:
C34H56O14Smiles:
CC1CC(C)C2C(C1)C(=O)C(C)C1C(C)CC(C)C(C(C)OC3OC(CO)C(O)C(OC4OC(CO)C(O)C(O)C4O)C3O)OC(=O)C12Aglycone:
CC1CC(C)C2C(C1)C(=O)C(C)C1C(C)CC(C)C(C(C)O)OC(=O)C12Sugarmoiety:
OCC1OC(OC2C(O)C(O)OC(CO)C2O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 14 | RingCount: | 5 |
| HBD: | 7 | FractionCSP3: | 0.94 |
| AlogP: | -0.65 | Num_rotatable_bonds: | 7 |
| MolWt: | 688.81 | Num_heavy_atoms: | 48 |
| TPSA: | 221.9 | NumAromaticRings: | 0 |
Unique Aglycone
AD52663
Formula: C22H36O4
Smiles:
CC1CC(C)C2C(C1)C(=O)C(C)C1C(C)CC(C)C(C(C)O)OC(=O)C12| HBA: | 4 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.91 |
| AlogP: | 3.7 | Num_rotatable_bonds: | 1 |
| MolWt: | 364.53 | Num_heavy_atoms: | 26 |
| TPSA: | 63.6 | NumAromaticRings: | 0 |
