Glycoside
GD124268
Name:
2-[(2,12-dihydroxy-2,6,10-trimethyldodeca-6,10-dien-3-yl)oxy]-6-(hydroxymethyl)oxane-3,4,5-triolFormula:
C21H38O8Smiles:
CC(=CCO)CCC=C(C)CCC(OC1OC(CO)C(O)C(O)C1O)C(C)(C)OAglycone:
CC(=CCO)CCC=C(C)CCC(O)C(C)(C)OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 1 |
| HBD: | 6 | FractionCSP3: | 0.81 |
| AlogP: | 0.39 | Num_rotatable_bonds: | 11 |
| MolWt: | 418.53 | Num_heavy_atoms: | 29 |
| TPSA: | 139.84 | NumAromaticRings: | 0 |
Unique Aglycone
AD50191
Formula: C15H28O3
Smiles:
CC(=CCO)CCC=C(C)CCC(O)C(C)(C)O| HBA: | 3 | RingCount: | 0 |
| HBD: | 3 | FractionCSP3: | 0.73 |
| AlogP: | 2.56 | Num_rotatable_bonds: | 8 |
| MolWt: | 256.39 | Num_heavy_atoms: | 18 |
| TPSA: | 60.69 | NumAromaticRings: | 0 |
