Glycoside
GD123438
Name:
7-[(7-acetyl-3,8-dihydroxy-6-methylnaphthalen-1-yl)oxy]-2,3,4,5-tetrahydroxyheptanalFormula:
C20H24O9Smiles:
CC(=O)c1c(C)cc2cc(O)cc(OCCC(O)C(O)C(O)C(O)C=O)c2c1OAglycone:
CCOc1cc(O)cc2cc(C)c(C(C)=O)c(O)c12Sugarmoiety:
O=CC(O)C(O)C(O)C(O)OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 2 |
| HBD: | 6 | FractionCSP3: | 0.4 |
| AlogP: | 0.17 | Num_rotatable_bonds: | 9 |
| MolWt: | 408.4 | Num_heavy_atoms: | 29 |
| TPSA: | 164.75 | NumAromaticRings: | 2 |
Unique Aglycone
AD49814
Formula: C15H16O4
Smiles:
CCOc1cc(O)cc2cc(C)c(C(C)=O)c(O)c12| HBA: | 4 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.27 |
| AlogP: | 3.16 | Num_rotatable_bonds: | 3 |
| MolWt: | 260.29 | Num_heavy_atoms: | 19 |
| TPSA: | 66.76 | NumAromaticRings: | 2 |
