Glycoside
GD140893
Name:
5,7-dihydroxy-6-{5-hydroxy-6-methyl-4-oxo-3-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]oxan-2-yl}-2-phenyl-4H-chromen-4-oneFormula:
C27H28O12Smiles:
CC1OC(c2c(O)cc3oc(-c4ccccc4)cc(=O)c3c2O)C(OC2OC(C)C(O)C(O)C2O)C(=O)C1OAglycone:
CC1OC(c2c(O)cc3oc(-c4ccccc4)cc(=O)c3c2O)C(O)C(=O)C1OSugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 5 |
| HBD: | 6 | FractionCSP3: | 0.41 |
| AlogP: | 0.47 | Num_rotatable_bonds: | 4 |
| MolWt: | 544.51 | Num_heavy_atoms: | 39 |
| TPSA: | 196.35 | NumAromaticRings: | 3 |
Unique Aglycone
AD56799
Formula: C21H18O8
Smiles:
CC1OC(c2c(O)cc3oc(-c4ccccc4)cc(=O)c3c2O)C(O)C(=O)C1O| HBA: | 8 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.24 |
| AlogP: | 1.62 | Num_rotatable_bonds: | 2 |
| MolWt: | 398.37 | Num_heavy_atoms: | 29 |
| TPSA: | 137.43 | NumAromaticRings: | 3 |
