Glycoside
GD121380
Name:
3Alpha-Angeloyloxy-18Beta-Glucopyranosyloxy-Ent-Labd-8(17),13-Dien-15,16-OlideFormula:
C31H46O10Smiles:
C=C1CCC2C(C)(COC3OC(CO)C(O)C(O)C3O)C(OC(=O)C(C)=CC)CCC2(C)C1CCC1=CC(=O)OC1Aglycone:
C=C1CCC2C(C)(CO)C(OC(=O)C(C)=CC)CCC2(C)C1CCC1=CC(=O)OC1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.74 |
| AlogP: | 2.33 | Num_rotatable_bonds: | 9 |
| MolWt: | 578.7 | Num_heavy_atoms: | 41 |
| TPSA: | 151.98 | NumAromaticRings: | 0 |
Unique Aglycone
AD48854
Formula: C25H36O5
Smiles:
C=C1CCC2C(C)(CO)C(OC(=O)C(C)=CC)CCC2(C)C1CCC1=CC(=O)OC1| HBA: | 5 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.68 |
| AlogP: | 4.51 | Num_rotatable_bonds: | 6 |
| MolWt: | 416.56 | Num_heavy_atoms: | 30 |
| TPSA: | 72.83 | NumAromaticRings: | 0 |
