Glycoside
GD155970
Name:
2-{[1,7-dihydroxy-1,6-dimethyl-4-(propan-2-yl)-1,2,3,4-tetrahydronaphthalen-2-yl]oxy}-6-(hydroxymethyl)oxane-3,4,5-triolFormula:
C21H32O8Smiles:
Cc1cc2c(cc1O)C(C)(O)C(OC1OC(CO)C(O)C(O)C1O)CC2C(C)CAglycone:
Cc1cc2c(cc1O)C(C)(O)C(O)CC2C(C)CSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.71 |
| AlogP: | 0.24 | Num_rotatable_bonds: | 4 |
| MolWt: | 412.48 | Num_heavy_atoms: | 29 |
| TPSA: | 139.84 | NumAromaticRings: | 1 |
Unique Aglycone
AD55134
Formula: C15H22O3
Smiles:
Cc1cc2c(cc1O)C(C)(O)C(O)CC2C(C)C| HBA: | 3 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.6 |
| AlogP: | 2.41 | Num_rotatable_bonds: | 1 |
| MolWt: | 250.34 | Num_heavy_atoms: | 18 |
| TPSA: | 60.69 | NumAromaticRings: | 1 |
