Glycoside
GD151156
Name:
apigeninidin 5,7-diglucosideFormula:
C27H33O14Smiles:
OCC1OC(Oc2cc(OC3OC(C[OH2+])C(O)C(O)C3O)cc3c2C=CC(c2ccc(O)cc2)O3)C(O)C(O)C1OAglycone:
Oc1ccc(C2C=Cc3c(O)cc(O)cc3O2)cc1Sugarmoiety:
OC1OC(C[OH2+])C(O)C(O)C1O.OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 14 | RingCount: | 5 |
| HBD: | 10 | FractionCSP3: | 0.48 |
| AlogP: | -2.37 | Num_rotatable_bonds: | 7 |
| MolWt: | 581.55 | Num_heavy_atoms: | 41 |
| TPSA: | 230.89 | NumAromaticRings: | 2 |
Unique Aglycone
AD55620
Formula: C15H12O4
Smiles:
Oc1ccc(C2C=Cc3c(O)cc(O)cc3O2)cc1| HBA: | 4 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.07 |
| AlogP: | 2.95 | Num_rotatable_bonds: | 1 |
| MolWt: | 256.26 | Num_heavy_atoms: | 19 |
| TPSA: | 69.92 | NumAromaticRings: | 2 |
