Glycoside
GD119461
Name:
2-({6-hydroxy-5-[5-hydroxy-3-(hydroxymethyl)pent-3-en-1-yl]-1,1,4a,6-tetramethyl-decahydronaphthalen-2-yl}oxy)-6-(hydroxymethyl)oxane-3,4,5-triolFormula:
C26H46O9Smiles:
CC1(O)CCC2C(C)(C)C(OC3OC(CO)C(O)C(O)C3O)CCC2(C)C1CCC(=CCO)COAglycone:
CC1(O)CCC2C(C)(C)C(O)CCC2(C)C1CCC(=CCO)COSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 7 | FractionCSP3: | 0.92 |
| AlogP: | 0.47 | Num_rotatable_bonds: | 8 |
| MolWt: | 502.65 | Num_heavy_atoms: | 35 |
| TPSA: | 160.07 | NumAromaticRings: | 0 |
Unique Aglycone
AD47866
Formula: C20H36O4
Smiles:
CC1(O)CCC2C(C)(C)C(O)CCC2(C)C1CCC(=CCO)CO| HBA: | 4 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.9 |
| AlogP: | 2.64 | Num_rotatable_bonds: | 5 |
| MolWt: | 340.5 | Num_heavy_atoms: | 24 |
| TPSA: | 80.92 | NumAromaticRings: | 0 |
