Glycoside
GD134440
Name:
2-{[2-(4a,8-dimethyl-7-oxo-1,2,3,4,4a,7,8,8a-octahydronaphthalen-2-yl)propan-2-yl]oxy}-5-(acetyloxy)-4-hydroxy-6-methyloxan-3-yl acetateFormula:
C25H38O8Smiles:
CC(=O)OC1C(C)OC(OC(C)(C)C2CCC3(C)C=CC(=O)C(C)C3C2)C(OC(C)=O)C1OAglycone:
CC1C(=O)C=CC2(C)CCC(C(C)(C)O)CC12Sugarmoiety:
CC(=O)OC1C(C)OC(O)C(OC(C)=O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.8 |
| AlogP: | 2.95 | Num_rotatable_bonds: | 5 |
| MolWt: | 466.57 | Num_heavy_atoms: | 33 |
| TPSA: | 108.36 | NumAromaticRings: | 0 |
Unique Aglycone
AD49277
Formula: C15H24O2
Smiles:
CC1C(=O)C=CC2(C)CCC(C(C)(C)O)CC12| HBA: | 2 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.8 |
| AlogP: | 2.95 | Num_rotatable_bonds: | 1 |
| MolWt: | 236.35 | Num_heavy_atoms: | 17 |
| TPSA: | 37.3 | NumAromaticRings: | 0 |
