Glycoside
GD147998
Name:
3Alpha-Angeloyloxy-2Beta,15,16-Trihydroxy-Ent-Labda-7,13E-Dien-2-O-Beta-[Fucopyranoside-4'-O-Acetate]Formula:
C33H52O10Smiles:
C=C(CCC1C(C)=CCC2C(C)(C)C(OC(=O)C(C)=CC)C(OC3OC(C)C(OC(C)=O)C(O)C3O)CC12C)C(O)COAglycone:
C=C(CCC1C(C)=CCC2C(C)(C)C(OC(=O)C(C)=CC)C(O)CC12C)C(O)COSugarmoiety:
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
AD59244
Formula: C25H40O5
Smiles:
C=C(CCC1C(C)=CCC2C(C)(C)C(OC(=O)C(C)=CC)C(O)CC12C)C(O)CO| HBA: | 5 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.72 |
| AlogP: | 3.93 | Num_rotatable_bonds: | 7 |
| MolWt: | 420.59 | Num_heavy_atoms: | 30 |
| TPSA: | 86.99 | NumAromaticRings: | 0 |
