Glycoside
GD135739
Name:
1-(4-hydroxyphenyl)-2-[(3,4,5-trihydroxy-6-{[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]methyl}oxan-2-yl)oxy]ethan-1-oneFormula:
C20H28O12Smiles:
CC1OC(OCC2OC(OCC(=O)c3ccc(O)cc3)C(O)C(O)C2O)C(O)C(O)C1OAglycone:
O=C(CO)c1ccc(O)cc1Sugarmoiety:
CC1OC(OCC2OC(O)C(O)C(O)C2O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 3 |
| HBD: | 7 | FractionCSP3: | 0.65 |
| AlogP: | -2.76 | Num_rotatable_bonds: | 7 |
| MolWt: | 460.43 | Num_heavy_atoms: | 32 |
| TPSA: | 195.6 | NumAromaticRings: | 1 |
Unique Aglycone
AD51890
Formula: C8H8O3
Smiles:
O=C(CO)c1ccc(O)cc1| HBA: | 3 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.12 |
| AlogP: | 0.57 | Num_rotatable_bonds: | 2 |
| MolWt: | 152.15 | Num_heavy_atoms: | 11 |
| TPSA: | 57.53 | NumAromaticRings: | 1 |
