Glycoside
GD116956
Name:
NoneFormula:
C29H26O12Smiles:
OCC1OC(Oc2c3cc(=C4C=C[C](O)C=C4)oc4cc(O)cc([oH+]c2-c2ccc(O)c(O)c2)c4-3)C(O)C(O)C1OAglycone:
Oc1cc2oc(=C3C=CC(O)C=C3)cc3c(O)c(-c4ccc(O)c(O)c4)[oH+]c(c1)c2-3Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 6 |
| HBD: | 9 | FractionCSP3: | 0.21 |
| AlogP: | 1.67 | Num_rotatable_bonds: | 4 |
| MolWt: | 566.52 | Num_heavy_atoms: | 41 |
| TPSA: | 206.24 | NumAromaticRings: | 2 |
Unique Aglycone
AD46550
Formula: C23H17O7
Smiles:
Oc1cc2oc(=C3C=CC(O)C=C3)cc3c(O)c(-c4ccc(O)c(O)c4)[oH+]c(c1)c2-3| HBA: | 7 | RingCount: | 5 |
| HBD: | 6 | FractionCSP3: | 0.04 |
| AlogP: | 3.65 | Num_rotatable_bonds: | 1 |
| MolWt: | 405.38 | Num_heavy_atoms: | 30 |
| TPSA: | 127.09 | NumAromaticRings: | 2 |
