Glycoside
GD141793
Name:
Pseudopterosin MFormula:
C27H38O7Smiles:
CC(=O)OC1C(Oc2c(C)c3c4c(c2O)C(C)CCC4C(C)CC3C=C(C)C)OCC(O)C1OAglycone:
CC(C)=CC1CC(C)C2CCC(C)c3c(O)c(O)c(C)c1c32Sugarmoiety:
CC(=O)OC1C(O)OCC(O)C1OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 4 |
| HBD: | 3 | FractionCSP3: | 0.67 |
| AlogP: | 4.16 | Num_rotatable_bonds: | 4 |
| MolWt: | 474.59 | Num_heavy_atoms: | 34 |
| TPSA: | 105.45 | NumAromaticRings: | 1 |
Unique Aglycone
AD01472
Formula: C20H28O2
Smiles:
CC(C)=CC1CC(C)C2CCC(C)c3c(O)c(O)c(C)c1c32| HBA: | 2 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.6 |
| AlogP: | 5.48 | Num_rotatable_bonds: | 1 |
| MolWt: | 300.44 | Num_heavy_atoms: | 22 |
| TPSA: | 40.46 | NumAromaticRings: | 1 |
