Glycoside
GD130470
Name:
(5-hydroxy-10-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-3,9-dioxatricyclo[4.4.0.0²,â´]dec-7-en-2-yl)methyl 3-(3,4-dihydroxyphenyl)prop-2-enoateFormula:
C24H28O13Smiles:
O=C(C=Cc1ccc(O)c(O)c1)OCC12OC1C(O)C1C=COC(OC3OC(CO)C(O)C(O)C3O)C12Aglycone:
O=C(C=Cc1ccc(O)c(O)c1)OCC12OC1C(O)C1C=COC(O)C12Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 13 | RingCount: | 5 |
| HBD: | 7 | FractionCSP3: | 0.54 |
| AlogP: | -1.91 | Num_rotatable_bonds: | 7 |
| MolWt: | 524.48 | Num_heavy_atoms: | 37 |
| TPSA: | 208.13 | NumAromaticRings: | 1 |
Unique Aglycone
AD47966
Formula: C18H18O8
Smiles:
O=C(C=Cc1ccc(O)c(O)c1)OCC12OC1C(O)C1C=COC(O)C12| HBA: | 8 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.39 |
| AlogP: | 0.26 | Num_rotatable_bonds: | 4 |
| MolWt: | 362.33 | Num_heavy_atoms: | 26 |
| TPSA: | 128.98 | NumAromaticRings: | 1 |
