Glycoside
GD148079
Name:
methyl 2-(1,7-dihydroxy-4a,8-dimethyl-5-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-decahydronaphthalen-2-yl)prop-2-enoateFormula:
C22H36O10Smiles:
C=C(C(=O)OC)C1CCC2(C)C(OC3OC(CO)C(O)C(O)C3O)CC(O)C(C)C2C1OAglycone:
C=C(C(=O)OC)C1CCC2(C)C(O)CC(O)C(C)C2C1OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.86 |
| AlogP: | -1.31 | Num_rotatable_bonds: | 5 |
| MolWt: | 460.52 | Num_heavy_atoms: | 32 |
| TPSA: | 166.14 | NumAromaticRings: | 0 |
Unique Aglycone
AD59270
Formula: C16H26O5
Smiles:
C=C(C(=O)OC)C1CCC2(C)C(O)CC(O)C(C)C2C1O| HBA: | 5 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.81 |
| AlogP: | 0.87 | Num_rotatable_bonds: | 2 |
| MolWt: | 298.38 | Num_heavy_atoms: | 21 |
| TPSA: | 86.99 | NumAromaticRings: | 0 |
