Glycoside
GD157444
Name:
Pyranocyanin BFormula:
C24H24O11Smiles:
CC1=CC2=C3C(=CC(O)=CC3O1)OC(c1ccc(O)c(O)c1)=C2OC1OC(CO)C(O)C(O)C1OAglycone:
CC1=CC2=C3C(=CC(O)=CC3O1)OC(c1ccc(O)c(O)c1)=C2OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 5 |
| HBD: | 7 | FractionCSP3: | 0.33 |
| AlogP: | 0.55 | Num_rotatable_bonds: | 4 |
| MolWt: | 488.45 | Num_heavy_atoms: | 35 |
| TPSA: | 178.53 | NumAromaticRings: | 1 |
Unique Aglycone
AD62247
Formula: C18H14O6
Smiles:
CC1=CC2=C3C(=CC(O)=CC3O1)OC(c1ccc(O)c(O)c1)=C2O| HBA: | 6 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.11 |
| AlogP: | 3.29 | Num_rotatable_bonds: | 1 |
| MolWt: | 326.3 | Num_heavy_atoms: | 24 |
| TPSA: | 99.38 | NumAromaticRings: | 1 |
