Glycoside
GD146514
Name:
6-hydroxy-4,7,7-trimethyl-5-{[3,4,4,5-tetrahydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}bicyclo[2.2.1]heptan-2-oneFormula:
C16H26O9Smiles:
CC1(C)C2C(=O)CC1(C)C(OC1OC(CO)C(O)C(O)(O)C1O)C2OAglycone:
CC1(C)C2C(=O)CC1(C)C(O)C2OSugarmoiety:
OCC1OC(O)C(O)C(O)(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.94 |
| AlogP: | -2.51 | Num_rotatable_bonds: | 3 |
| MolWt: | 362.38 | Num_heavy_atoms: | 25 |
| TPSA: | 156.91 | NumAromaticRings: | 0 |
Unique Aglycone
AD58743
Formula: C10H16O3
Smiles:
CC1(C)C2C(=O)CC1(C)C(O)C2O| HBA: | 3 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.9 |
| AlogP: | 0.34 | Num_rotatable_bonds: | 0 |
| MolWt: | 184.24 | Num_heavy_atoms: | 13 |
| TPSA: | 57.53 | NumAromaticRings: | 0 |
