Glycoside
GD130117
Name:
2,3,4,7-tetramethoxy-1-[(3,4,5-trihydroxy-6-{[(3,4,5-trihydroxyoxan-2-yl)oxy]methyl}oxan-2-yl)oxy]-9H-xanthen-9-oneFormula:
C28H34O16Smiles:
COc1ccc2oc3c(OC)c(OC)c(OC)c(OC4OC(COC5OCC(O)C(O)C5O)C(O)C(O)C4O)c3c(=O)c2c1Aglycone:
COc1ccc2oc3c(OC)c(OC)c(OC)c(O)c3c(=O)c2c1Sugarmoiety:
OC1COC(OCC2OC(O)C(O)C(O)C2O)C(O)C1OOther Identifiers
Properties
| HBA: | 16 | RingCount: | 5 |
| HBD: | 6 | FractionCSP3: | 0.54 |
| AlogP: | -1.38 | Num_rotatable_bonds: | 9 |
| MolWt: | 626.56 | Num_heavy_atoms: | 44 |
| TPSA: | 225.43 | NumAromaticRings: | 3 |
Unique Aglycone
AD52720
Formula: C17H16O7
Smiles:
COc1ccc2oc3c(OC)c(OC)c(OC)c(O)c3c(=O)c2c1| HBA: | 7 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.24 |
| AlogP: | 2.69 | Num_rotatable_bonds: | 4 |
| MolWt: | 332.31 | Num_heavy_atoms: | 24 |
| TPSA: | 87.36 | NumAromaticRings: | 3 |
