Glycoside
GD026140
Name:
4,8-dihydroxy-3,5,7,9,11,13,15,17-octamethyl-12-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}nonadeca-5,9-dienoic acidFormula:
C33H60O10Smiles:
CCC(C)CC(C)CC(C)C(O[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O)C(C)C=C(C)C(O)C(C)C=C(C)C(O)C(C)CC(=O)OAglycone:
CCC(C)CC(C)CC(C)C(O)C(C)C=C(C)C(O)C(C)C=C(C)C(O)C(C)CC(=O)OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 1 |
| HBD: | 7 | FractionCSP3: | 0.85 |
| AlogP: | 3.27 | Num_rotatable_bonds: | 18 |
| MolWt: | 616.83 | Num_heavy_atoms: | 43 |
| TPSA: | 177.14 | NumAromaticRings: | 0 |
Unique Aglycone
AD17253
Formula: C27H50O5
Smiles:
CCC(C)CC(C)CC(C)C(O)C(C)C=C(C)C(O)C(C)C=C(C)C(O)C(C)CC(=O)O| HBA: | 5 | RingCount: | 0 |
| HBD: | 4 | FractionCSP3: | 0.81 |
| AlogP: | 5.44 | Num_rotatable_bonds: | 15 |
| MolWt: | 454.69 | Num_heavy_atoms: | 32 |
| TPSA: | 97.99 | NumAromaticRings: | 0 |
