Glycoside
GD138225
Name:
2-(hydroxymethyl)-6-[(4,8,9-trihydroxy-6-methyl-1,2,3,4-tetrahydroanthracen-1-yl)oxy]oxane-3,4,5-triolFormula:
C21H26O9Smiles:
Cc1cc(O)c2c(O)c3c(cc2c1)C(O)CCC3OC1OC(CO)C(O)C(O)C1OAglycone:
Cc1cc(O)c2c(O)c3c(cc2c1)C(O)CCC3OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 4 |
| HBD: | 7 | FractionCSP3: | 0.52 |
| AlogP: | 0.24 | Num_rotatable_bonds: | 3 |
| MolWt: | 422.43 | Num_heavy_atoms: | 30 |
| TPSA: | 160.07 | NumAromaticRings: | 2 |
Unique Aglycone
AD55814
Formula: C15H16O4
Smiles:
Cc1cc(O)c2c(O)c3c(cc2c1)C(O)CCC3O| HBA: | 4 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.33 |
| AlogP: | 2.42 | Num_rotatable_bonds: | 0 |
| MolWt: | 260.29 | Num_heavy_atoms: | 19 |
| TPSA: | 80.92 | NumAromaticRings: | 2 |
