Glycoside
GD143754
Name:
NoneFormula:
C27H30O19Smiles:
O=c1c(O)c(-c2ccc(O)c(O)c2)oc2c(C3(O)OC(CO)C(O)C(O)C3O)c(O)c(C3(O)OC(CO)C(O)C(O)C3O)c(O)c12Aglycone:
O=c1c(O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12Sugarmoiety:
OCC1OC(O)(O)C(O)C(O)C1O.OCC1OC(O)(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 19 | RingCount: | 5 |
| HBD: | 15 | FractionCSP3: | 0.44 |
| AlogP: | -4.77 | Num_rotatable_bonds: | 5 |
| MolWt: | 658.52 | Num_heavy_atoms: | 46 |
| TPSA: | 352.12 | NumAromaticRings: | 3 |
Unique Aglycone
AD00377
Formula: C15H10O7
Smiles:
O=c1c(O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12| HBA: | 7 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.0 |
| AlogP: | 1.99 | Num_rotatable_bonds: | 1 |
| MolWt: | 302.24 | Num_heavy_atoms: | 22 |
| TPSA: | 131.36 | NumAromaticRings: | 3 |
