Glycoside
GD138477
Name:
peonidin 3-arabinosideFormula:
C21H23O10Smiles:
COc1cc(C2Oc3cc([OH2+])cc(O)c3C=C2OC2OCC(O)C(O)C2O)ccc1OAglycone:
COc1cc(C2Oc3cc([OH2+])cc(O)c3C=C2O)ccc1OSugarmoiety:
OC1COC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 4 |
| HBD: | 7 | FractionCSP3: | 0.33 |
| AlogP: | 0.47 | Num_rotatable_bonds: | 4 |
| MolWt: | 435.41 | Num_heavy_atoms: | 31 |
| TPSA: | 160.97 | NumAromaticRings: | 2 |
Unique Aglycone
AD51633
Formula: C16H15O6
Smiles:
COc1cc(C2Oc3cc([OH2+])cc(O)c3C=C2O)ccc1O| HBA: | 6 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.12 |
| AlogP: | 2.58 | Num_rotatable_bonds: | 2 |
| MolWt: | 303.29 | Num_heavy_atoms: | 22 |
| TPSA: | 102.05 | NumAromaticRings: | 2 |
