Glycoside
GD034095
Name:
NoneFormula:
C26H38O9Smiles:
C=C[C@@]1(C)C=C2C(=O)[C@H](O)[C@@H]3C(C)(C)CCC[C@@]3(C(=O)O[C@@H]3O[C@H](CO)[C@H](O)[C@H](O)[C@H]3O)[C@H]2CC1Aglycone:
C=CC1(C)C=C2C(=O)C(O)C3C(C)(C)CCCC3(C(=O)O)C2CC1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.77 |
| AlogP: | 0.61 | Num_rotatable_bonds: | 4 |
| MolWt: | 494.58 | Num_heavy_atoms: | 35 |
| TPSA: | 153.75 | NumAromaticRings: | 0 |
Unique Aglycone
AD21708
Formula: C20H28O4
Smiles:
C=CC1(C)C=C2C(=O)C(O)C3C(C)(C)CCCC3(C(=O)O)C2CC1| HBA: | 4 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.7 |
| AlogP: | 3.36 | Num_rotatable_bonds: | 2 |
| MolWt: | 332.44 | Num_heavy_atoms: | 24 |
| TPSA: | 74.6 | NumAromaticRings: | 0 |
