Glycoside
GD150395
Name:
4,5-bis(acetyloxy)-6-({2-[8-(hydroxymethyl)-4a-methyl-1,2,3,4,4a,5,6,7-octahydronaphthalen-2-yl]propan-2-yl}oxy)oxan-3-yl acetateFormula:
C26H40O9Smiles:
CC(=O)OC1COC(OC(C)(C)C2CCC3(C)CCCC(CO)=C3C2)C(OC(C)=O)C1OC(C)=OAglycone:
CC12CCCC(CO)=C1CC(C(C)(C)O)CC2Sugarmoiety:
CC(=O)OC1COC(O)C(OC(C)=O)C1OC(C)=OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.81 |
| AlogP: | 3.21 | Num_rotatable_bonds: | 7 |
| MolWt: | 496.6 | Num_heavy_atoms: | 35 |
| TPSA: | 117.59 | NumAromaticRings: | 0 |
Unique Aglycone
AD49609
Formula: C15H26O2
Smiles:
CC12CCCC(CO)=C1CC(C(C)(C)O)CC2| HBA: | 2 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.87 |
| AlogP: | 3.04 | Num_rotatable_bonds: | 2 |
| MolWt: | 238.37 | Num_heavy_atoms: | 17 |
| TPSA: | 40.46 | NumAromaticRings: | 0 |
