Glycoside
GD052691
Name:
NoneFormula:
C14H22O8Smiles:
CC(C)(C)C(=O)O[C@H](C(=O)O)[C@H](OC(=O)C(C)(C)C)C(=O)OAglycone:
CC(C)(C)C=O.CC(C)(C)C=OSugarmoiety:
O=C(O)C(OO)C(OO)C(=O)OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 0 |
| HBD: | 2 | FractionCSP3: | 0.71 |
| AlogP: | 1.07 | Num_rotatable_bonds: | 5 |
| MolWt: | 318.32 | Num_heavy_atoms: | 22 |
| TPSA: | 127.2 | NumAromaticRings: | 0 |
Unique Aglycone
AD27194
Formula: C5H10O
Smiles:
CC(C)(C)C=O| HBA: | 1 | RingCount: | 0 |
| HBD: | 0 | FractionCSP3: | 0.8 |
| AlogP: | 1.23 | Num_rotatable_bonds: | 0 |
| MolWt: | 86.13 | Num_heavy_atoms: | 6 |
| TPSA: | 17.07 | NumAromaticRings: | 0 |
