Glycoside
GD019650
Name:
NoneFormula:
C34H54O10Smiles:
COC[C@@H]1C[C@H](OC)[C@H](O)CCC=C(C)C=C[C@H](O[C@@H]2O[C@H](C)[C@H](OC)[C@H](O)[C@H]2O)[C@H](C)C=C(C)C=C(C)C=C(C)C(=O)O1Aglycone:
COCC1CC(OC)C(O)CCC=C(C)C=CC(O)C(C)C=C(C)C=C(C)C=C(C)C(=O)O1Sugarmoiety:
COC1C(C)OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.68 |
| AlogP: | 3.95 | Num_rotatable_bonds: | 6 |
| MolWt: | 622.8 | Num_heavy_atoms: | 44 |
| TPSA: | 133.14 | NumAromaticRings: | 0 |
Unique Aglycone
AD13687
Formula: C27H42O6
Smiles:
COCC1CC(OC)C(O)CCC=C(C)C=CC(O)C(C)C=C(C)C=C(C)C=C(C)C(=O)O1| HBA: | 6 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.59 |
| AlogP: | 4.44 | Num_rotatable_bonds: | 3 |
| MolWt: | 462.63 | Num_heavy_atoms: | 33 |
| TPSA: | 85.22 | NumAromaticRings: | 0 |
