Glycoside
GD023702
Name:
NoneFormula:
C33H50O10Smiles:
C#CCCCC=CC=CC1CC(C)=C[C@H](OC)C[C@@H]2O[C@](O)(CC(O[C@@H]3O[C@H](C)[C@H](O)[C@H](O)[C@H]3OC)[C@H]2C)[C@H](C)C(=O)O1Aglycone:
C#CCCCC=CC=CC1CC(C)=CC(OC)CC2OC(O)(CC(O)C2C)C(C)C(=O)O1Sugarmoiety:
COC1C(O)OC(C)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.73 |
| AlogP: | 3.19 | Num_rotatable_bonds: | 9 |
| MolWt: | 606.75 | Num_heavy_atoms: | 43 |
| TPSA: | 133.14 | NumAromaticRings: | 0 |
Unique Aglycone
AD15917
Formula: C26H38O6
Smiles:
C#CCCCC=CC=CC1CC(C)=CC(OC)CC2OC(O)(CC(O)C2C)C(C)C(=O)O1| HBA: | 6 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.65 |
| AlogP: | 3.68 | Num_rotatable_bonds: | 6 |
| MolWt: | 446.58 | Num_heavy_atoms: | 32 |
| TPSA: | 85.22 | NumAromaticRings: | 0 |
