Glycoside
GD131537
Name:
NoneFormula:
C24H24O12Smiles:
CC1=CC2=C3[C](C=C(O)C=C3[OH+]C(c3cc(O)c(O)c(O)c3)=C2OC2OC(CO)C(O)C(O)C2O)O1Aglycone:
CC1=CC2=C3C(=CC(O)=CC3O1)[OH+]C(c1cc(O)c(O)c(O)c1)=C2OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 5 |
| HBD: | 9 | FractionCSP3: | 0.29 |
| AlogP: | 0.5 | Num_rotatable_bonds: | 4 |
| MolWt: | 504.44 | Num_heavy_atoms: | 36 |
| TPSA: | 202.33 | NumAromaticRings: | 1 |
Unique Aglycone
AD46630
Formula: C18H15O7
Smiles:
CC1=CC2=C3C(=CC(O)=CC3O1)[OH+]C(c1cc(O)c(O)c(O)c1)=C2O| HBA: | 7 | RingCount: | 4 |
| HBD: | 6 | FractionCSP3: | 0.11 |
| AlogP: | 3.08 | Num_rotatable_bonds: | 1 |
| MolWt: | 343.31 | Num_heavy_atoms: | 25 |
| TPSA: | 123.18 | NumAromaticRings: | 1 |
