Glycoside
GD136740
Name:
3Alpha-Angeloyloxy-2Beta,15,16-Trihydroxy-Ent-Labda-7,13E-Dien-2-O-Beta-[Fucopyranoside-4'-O-Acetate]Formula:
C33H52O10Smiles:
CC=C(C)C(=O)OC1C(OC2OC(C)C(OC(C)=O)C(O)C2O)CC2(C)C(CCC(=CCO)CO)C(C)=CCC2C1(C)CAglycone:
CC=C(C)C(=O)OC1C(O)CC2(C)C(CCC(=CCO)CO)C(C)=CCC2C1(C)CSugarmoiety:
CC(=O)OC1C(C)OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.76 |
| AlogP: | 3.36 | Num_rotatable_bonds: | 10 |
| MolWt: | 608.77 | Num_heavy_atoms: | 43 |
| TPSA: | 151.98 | NumAromaticRings: | 0 |
Unique Aglycone
AD55273
Formula: C25H40O5
Smiles:
CC=C(C)C(=O)OC1C(O)CC2(C)C(CCC(=CCO)CO)C(C)=CCC2C1(C)C| HBA: | 5 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.72 |
| AlogP: | 3.94 | Num_rotatable_bonds: | 7 |
| MolWt: | 420.59 | Num_heavy_atoms: | 30 |
| TPSA: | 86.99 | NumAromaticRings: | 0 |
