Glycoside
GD006512
Name:
LINIFOLIOSIDEFormula:
C33H52O11Smiles:
C=C[C@@]1(C)C=C2C(=O)C[C@]3(C)C(C)(C)[C@H](O[C@@H]4O[C@H](CO)[C@H](O)[C@H](O)[C@H]4O[C@@H]4O[C@H](C)[C@H](O)[C@H](O)[C@H]4O)CC[C@@]3(C)[C@H]2CC1Aglycone:
C=CC1(C)C=C2C(=O)CC3(C)C(C)(C)C(O)CCC3(C)C2CC1Sugarmoiety:
CC1OC(OC2C(O)OC(CO)C(O)C2O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 5 |
| HBD: | 6 | FractionCSP3: | 0.85 |
| AlogP: | 1.36 | Num_rotatable_bonds: | 6 |
| MolWt: | 624.77 | Num_heavy_atoms: | 44 |
| TPSA: | 175.37 | NumAromaticRings: | 0 |
Unique Aglycone
AD05382
Formula: C21H32O2
Smiles:
C=CC1(C)C=C2C(=O)CC3(C)C(C)(C)C(O)CCC3(C)C2CC1| HBA: | 2 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.76 |
| AlogP: | 4.68 | Num_rotatable_bonds: | 1 |
| MolWt: | 316.49 | Num_heavy_atoms: | 23 |
| TPSA: | 37.3 | NumAromaticRings: | 0 |
