Glycoside
GD128154
Name:
3Alpha-Angeloyloxy-2Beta,15-Dihydroxy-Ent-Labda-7,13E-Dien-2-O-Beta-[Rhamnopyranoside-4'-O-Acetate]Formula:
C33H52O9Smiles:
CC=C(C)C(=O)OC1C(OC2OC(C)C(OC(C)=O)C(O)C2O)CC2(C)C(CCC(C)=CCO)C(C)=CCC2C1(C)CAglycone:
CC=C(C)C(=O)OC1C(O)CC2(C)C(CCC(C)=CCO)C(C)=CCC2C1(C)CSugarmoiety:
CC(=O)OC1C(C)OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.76 |
| AlogP: | 4.39 | Num_rotatable_bonds: | 9 |
| MolWt: | 592.77 | Num_heavy_atoms: | 42 |
| TPSA: | 131.75 | NumAromaticRings: | 0 |
Unique Aglycone
AD44913
Formula: C25H40O4
Smiles:
CC=C(C)C(=O)OC1C(O)CC2(C)C(CCC(C)=CCO)C(C)=CCC2C1(C)C| HBA: | 4 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.72 |
| AlogP: | 4.96 | Num_rotatable_bonds: | 6 |
| MolWt: | 404.59 | Num_heavy_atoms: | 29 |
| TPSA: | 66.76 | NumAromaticRings: | 0 |
