Glycoside
GD128953
Name:
3,4,5-trihydroxy-6-({2-methyl-2-[4-(1,2,3,4-tetrahydronaphthalen-1-yl)phenoxy]propanoyl}oxy)oxane-2-carboxylic acidFormula:
C26H30O9Smiles:
CC(C)(Oc1ccc(C2CCCc3ccccc32)cc1)C(=O)OC1OC(C(=O)O)C(O)C(O)C1OAglycone:
CC(C)(Oc1ccc(C2CCCc3ccccc32)cc1)C(=O)OSugarmoiety:
O=C(O)C1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.46 |
| AlogP: | 1.75 | Num_rotatable_bonds: | 6 |
| MolWt: | 486.52 | Num_heavy_atoms: | 35 |
| TPSA: | 142.75 | NumAromaticRings: | 2 |
Unique Aglycone
AD15142
Formula: C20H22O3
Smiles:
CC(C)(Oc1ccc(C2CCCc3ccccc32)cc1)C(=O)O| HBA: | 3 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.35 |
| AlogP: | 4.4 | Num_rotatable_bonds: | 4 |
| MolWt: | 310.39 | Num_heavy_atoms: | 23 |
| TPSA: | 46.53 | NumAromaticRings: | 2 |
