Glycoside
GD140697
Name:
NoneFormula:
C21H23O10Smiles:
CC1OC(OC2=C(c3ccc(O)c(O)c3)OC3C=C([OH2+])C=C(O)C3=C2)C(O)C(O)C1OAglycone:
OC1=CC([OH2+])=CC2OC(c3ccc(O)c(O)c3)=C(O)C=C12Sugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 4 |
| HBD: | 8 | FractionCSP3: | 0.33 |
| AlogP: | 0.0 | Num_rotatable_bonds: | 3 |
| MolWt: | 435.41 | Num_heavy_atoms: | 31 |
| TPSA: | 171.97 | NumAromaticRings: | 1 |
Unique Aglycone
AD45113
Formula: C15H13O6
Smiles:
OC1=CC([OH2+])=CC2OC(c3ccc(O)c(O)c3)=C(O)C=C12| HBA: | 6 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.07 |
| AlogP: | 1.71 | Num_rotatable_bonds: | 1 |
| MolWt: | 289.26 | Num_heavy_atoms: | 21 |
| TPSA: | 113.05 | NumAromaticRings: | 1 |
