Glycoside
GD144967
Name:
4,5-bis(acetyloxy)-6-{[2-(7-hydroxy-4a-methyl-8-methylidene-decahydronaphthalen-2-yl)propan-2-yl]oxy}oxan-3-yl acetateFormula:
C26H40O9Smiles:
C=C1C(O)CCC2(C)CCC(C(C)(C)OC3OCC(OC(C)=O)C(OC(C)=O)C3OC(C)=O)CC12Aglycone:
C=C1C(O)CCC2(C)CCC(C(C)(C)O)CC12Sugarmoiety:
CC(=O)OC1COC(O)C(OC(C)=O)C1OC(C)=OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.81 |
| AlogP: | 3.07 | Num_rotatable_bonds: | 6 |
| MolWt: | 496.6 | Num_heavy_atoms: | 35 |
| TPSA: | 117.59 | NumAromaticRings: | 0 |
Unique Aglycone
AD55765
Formula: C15H26O2
Smiles:
C=C1C(O)CCC2(C)CCC(C(C)(C)O)CC12| HBA: | 2 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.87 |
| AlogP: | 2.89 | Num_rotatable_bonds: | 1 |
| MolWt: | 238.37 | Num_heavy_atoms: | 17 |
| TPSA: | 40.46 | NumAromaticRings: | 0 |
