Glycoside
GD152407
Name:
[3,4,5-tris(acetyloxy)-6-({4,7-dimethyl-1H,4aH,5H,6H,7H,7aH-cyclopenta[c]pyran-1-yl}oxy)oxan-2-yl]methyl acetateFormula:
C24H34O11Smiles:
CC(=O)OCC1OC(OC2OC=C(C)C3CCC(C)C23)C(OC(C)=O)C(OC(C)=O)C1OC(C)=OAglycone:
CC1=COC(O)C2C(C)CCC12.COC(C)=OSugarmoiety:
CC(=O)OC1C(O)OC(O)C(OC(C)=O)C1OC(C)=OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 3 |
| HBD: | 0 | FractionCSP3: | 0.75 |
| AlogP: | 2.01 | Num_rotatable_bonds: | 7 |
| MolWt: | 498.53 | Num_heavy_atoms: | 35 |
| TPSA: | 132.89 | NumAromaticRings: | 0 |
Unique Aglycone
AD00017
Formula: C3H6O2
Smiles:
COC(C)=O| HBA: | 2 | RingCount: | 0 |
| HBD: | 0 | FractionCSP3: | 0.67 |
| AlogP: | 0.18 | Num_rotatable_bonds: | 0 |
| MolWt: | 74.08 | Num_heavy_atoms: | 5 |
| TPSA: | 26.3 | NumAromaticRings: | 0 |
AD59325
Formula: C10H16O2
Smiles:
CC1=COC(O)C2C(C)CCC12| HBA: | 2 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.8 |
| AlogP: | 1.9 | Num_rotatable_bonds: | 0 |
| MolWt: | 168.24 | Num_heavy_atoms: | 12 |
| TPSA: | 29.46 | NumAromaticRings: | 0 |
