Glycoside
GD157487
Name:
Celephthalide CFormula:
C18H28O8Smiles:
CC(CCC1OC(=O)C2=CCCCC21)OC1OC(CO)C(O)C(O)C1OAglycone:
CC(O)CCC1OC(=O)C2=CCCCC21Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.83 |
| AlogP: | -0.38 | Num_rotatable_bonds: | 6 |
| MolWt: | 372.41 | Num_heavy_atoms: | 26 |
| TPSA: | 125.68 | NumAromaticRings: | 0 |
Unique Aglycone
AD62256
Formula: C12H18O3
Smiles:
CC(O)CCC1OC(=O)C2=CCCCC21| HBA: | 3 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.75 |
| AlogP: | 1.8 | Num_rotatable_bonds: | 3 |
| MolWt: | 210.27 | Num_heavy_atoms: | 15 |
| TPSA: | 46.53 | NumAromaticRings: | 0 |
