Glycoside
GD141360
Name:
NoneFormula:
C20H21O11Smiles:
OC1=CC([OH2+])=CC2OC(c3cc(O)c(O)c(O)c3)=C(OC3OCC(O)C(O)C3O)C=C12Aglycone:
OC1=CC([OH2+])=CC2OC(c3cc(O)c(O)c(O)c3)=C(O)C=C12Sugarmoiety:
OC1COC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 4 |
| HBD: | 9 | FractionCSP3: | 0.3 |
| AlogP: | -0.68 | Num_rotatable_bonds: | 3 |
| MolWt: | 437.38 | Num_heavy_atoms: | 31 |
| TPSA: | 192.2 | NumAromaticRings: | 1 |
Unique Aglycone
AD45114
Formula: C15H13O7
Smiles:
OC1=CC([OH2+])=CC2OC(c3cc(O)c(O)c(O)c3)=C(O)C=C12| HBA: | 7 | RingCount: | 3 |
| HBD: | 7 | FractionCSP3: | 0.07 |
| AlogP: | 1.42 | Num_rotatable_bonds: | 1 |
| MolWt: | 305.26 | Num_heavy_atoms: | 22 |
| TPSA: | 133.28 | NumAromaticRings: | 1 |
