Glycoside
GD003989
Name:
2,5,7-trimethyl-6-(2-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}ethyl)-2,3-dihydro-1H-inden-1-oneFormula:
C20H28O7Smiles:
Cc1cc2c(c(C)c1CCO[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O)C(=O)[C@H](C)C2Aglycone:
Cc1cc2c(c(C)c1CCO)C(=O)C(C)C2Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.65 |
| AlogP: | 0.04 | Num_rotatable_bonds: | 5 |
| MolWt: | 380.44 | Num_heavy_atoms: | 27 |
| TPSA: | 116.45 | NumAromaticRings: | 1 |
Unique Aglycone
AD02049
Formula: C14H18O2
Smiles:
Cc1cc2c(c(C)c1CCO)C(=O)C(C)C2| HBA: | 2 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.5 |
| AlogP: | 2.21 | Num_rotatable_bonds: | 2 |
| MolWt: | 218.3 | Num_heavy_atoms: | 16 |
| TPSA: | 37.3 | NumAromaticRings: | 1 |
