Glycoside
GD029850
Name:
NoneFormula:
C62H118O13Smiles:
CCCCCCCCCCCC(CCCCCCCCCCC)CC(=O)OC[C@@H]1O[C@H](O[C@@H]2O[C@H](COC(=O)CC(CCCCCCCCCCC)CCCCCCCCCCC)[C@H](O)[C@H](O)[C@H]2O)[C@H](O)[C@H](O)[C@H]1OAglycone:
CCCCCCCCCCCC(CCCCCCCCCCC)CC(=O)OC.CCCCCCCCCCCC(CCCCCCCCCCC)CC(=O)OCSugarmoiety:
OC1OC(OC2OC(O)C(O)C(O)C2O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 13 | RingCount: | 2 |
| HBD: | 6 | FractionCSP3: | 0.97 |
| AlogP: | 13.4 | Num_rotatable_bonds: | 50 |
| MolWt: | 1071.61 | Num_heavy_atoms: | 75 |
| TPSA: | 201.67 | NumAromaticRings: | 0 |
Unique Aglycone
AD19367
Formula: C26H52O2
Smiles:
CCCCCCCCCCCC(CCCCCCCCCCC)CC(=O)OC| HBA: | 2 | RingCount: | 0 |
| HBD: | 0 | FractionCSP3: | 0.96 |
| AlogP: | 9.01 | Num_rotatable_bonds: | 22 |
| MolWt: | 396.7 | Num_heavy_atoms: | 28 |
| TPSA: | 26.3 | NumAromaticRings: | 0 |
