Glycoside
GD134940
Name:
7-{[4,5-dihydroxy-6-(hydroxymethyl)-3-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]oxan-2-yl]oxy}-5-hydroxy-4H-chromen-4-oneFormula:
C21H26O13Smiles:
CC1OC(OC2C(Oc3cc(O)c4c(=O)ccoc4c3)OC(CO)C(O)C2O)C(O)C(O)C1OAglycone:
O=c1ccoc2cc(O)cc(O)c12Sugarmoiety:
CC1OC(OC2C(O)OC(CO)C(O)C2O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 13 | RingCount: | 4 |
| HBD: | 7 | FractionCSP3: | 0.57 |
| AlogP: | -2.47 | Num_rotatable_bonds: | 5 |
| MolWt: | 486.43 | Num_heavy_atoms: | 34 |
| TPSA: | 208.74 | NumAromaticRings: | 2 |
Unique Aglycone
AD22716
Formula: C9H6O4
Smiles:
O=c1ccoc2cc(O)cc(O)c12| HBA: | 4 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | 1.2 | Num_rotatable_bonds: | 0 |
| MolWt: | 178.14 | Num_heavy_atoms: | 13 |
| TPSA: | 70.67 | NumAromaticRings: | 2 |
