Glycoside
GD116370
Name:
NoneFormula:
C26H31O16Smiles:
OC1=CC2OC(c3cc(O)c(O)c(O)c3)=C(OC3OC(C[OH2+])C(O)C(O)C3OC3OCC(O)C(O)C3O)C=C2C(O)=C1Aglycone:
OC1=CC2OC(c3cc(O)c(O)c(O)c3)=C(O)C=C2C(O)=C1Sugarmoiety:
OC1COC(OC2C(O)OC(C[OH2+])C(O)C2O)C(O)C1OOther Identifiers
Properties
| HBA: | 16 | RingCount: | 5 |
| HBD: | 12 | FractionCSP3: | 0.46 |
| AlogP: | -2.29 | Num_rotatable_bonds: | 6 |
| MolWt: | 599.52 | Num_heavy_atoms: | 42 |
| TPSA: | 271.35 | NumAromaticRings: | 1 |
Unique Aglycone
AD45076
Formula: C15H12O7
Smiles:
OC1=CC2OC(c3cc(O)c(O)c(O)c3)=C(O)C=C2C(O)=C1| HBA: | 7 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.07 |
| AlogP: | 2.25 | Num_rotatable_bonds: | 1 |
| MolWt: | 304.25 | Num_heavy_atoms: | 22 |
| TPSA: | 130.61 | NumAromaticRings: | 1 |
