Glycoside
GD153533
Name:
NoneFormula:
C27H33O17Smiles:
OC1=CC2OC(c3cc(O)c(O)c(O)c3)=C(OC3OC(COC4OC(C[OH2+])C(O)C(O)C4O)C(O)C(O)C3O)C=C2C(O)=C1Aglycone:
OC1=CC2OC(c3cc(O)c(O)c(O)c3)=C(O)C=C2C(O)=C1Sugarmoiety:
OC1OC(COC2OC(C[OH2+])C(O)C(O)C2O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 17 | RingCount: | 5 |
| HBD: | 13 | FractionCSP3: | 0.48 |
| AlogP: | -2.93 | Num_rotatable_bonds: | 7 |
| MolWt: | 629.54 | Num_heavy_atoms: | 44 |
| TPSA: | 291.58 | 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 |
