Glycoside
GD104177
Name:
15-hydroxy-2,15-dimethyl-3-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}hexadecanoic acidFormula:
C24H46O9Smiles:
C[C@H](C(=O)O)[C@@H](CCCCCCCCCCCC(C)(C)O)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1OAglycone:
CC(C(=O)O)C(O)CCCCCCCCCCCC(C)(C)OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 1 |
| HBD: | 6 | FractionCSP3: | 0.96 |
| AlogP: | 1.95 | Num_rotatable_bonds: | 17 |
| MolWt: | 478.62 | Num_heavy_atoms: | 33 |
| TPSA: | 156.91 | NumAromaticRings: | 0 |
Unique Aglycone
AD43973
Formula: C18H36O4
Smiles:
CC(C(=O)O)C(O)CCCCCCCCCCCC(C)(C)O| HBA: | 4 | RingCount: | 0 |
| HBD: | 3 | FractionCSP3: | 0.94 |
| AlogP: | 4.13 | Num_rotatable_bonds: | 14 |
| MolWt: | 316.48 | Num_heavy_atoms: | 22 |
| TPSA: | 77.76 | NumAromaticRings: | 0 |
