Glycoside
GD144871
Name:
3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl 2-(2-hydroxy-3,8-dimethylidene-decahydroazulen-5-yl)prop-2-enoateFormula:
C21H30O8Smiles:
C=C(C(=O)OC1OC(CO)C(O)C(O)C1O)C1CCC(=C)C2CC(O)C(=C)C2C1Aglycone:
C=C(C(=O)O)C1CCC(=C)C2CC(O)C(=C)C2C1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.67 |
| AlogP: | -0.2 | Num_rotatable_bonds: | 4 |
| MolWt: | 410.46 | Num_heavy_atoms: | 29 |
| TPSA: | 136.68 | NumAromaticRings: | 0 |
Unique Aglycone
AD58183
Formula: C15H20O3
Smiles:
C=C(C(=O)O)C1CCC(=C)C2CC(O)C(=C)C2C1| HBA: | 3 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.53 |
| AlogP: | 2.54 | Num_rotatable_bonds: | 2 |
| MolWt: | 248.32 | Num_heavy_atoms: | 18 |
| TPSA: | 57.53 | NumAromaticRings: | 0 |
