Glycoside
GD143121
Name:
Culcitiolide JFormula:
C21H34O8Smiles:
C=C(CO)C1CC(=O)C2CCC(OC3OC(CO)C(O)C(O)C3O)C(C)C2(C)C1Aglycone:
C=C(CO)C1CC(=O)C2CCC(O)C(C)C2(C)C1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.86 |
| AlogP: | -0.25 | Num_rotatable_bonds: | 5 |
| MolWt: | 414.5 | Num_heavy_atoms: | 29 |
| TPSA: | 136.68 | NumAromaticRings: | 0 |
Unique Aglycone
AD57573
Formula: C15H24O3
Smiles:
C=C(CO)C1CC(=O)C2CCC(O)C(C)C2(C)C1| HBA: | 3 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.8 |
| AlogP: | 1.93 | Num_rotatable_bonds: | 2 |
| MolWt: | 252.35 | Num_heavy_atoms: | 18 |
| TPSA: | 57.53 | NumAromaticRings: | 0 |
