Glycoside
GD121517
Name:
1,2,3,4,6-pentamethoxy-8-[(3,4,5-trihydroxy-6-{[(3,4,5-trihydroxyoxan-2-yl)oxy]methyl}oxan-2-yl)oxy]-9H-xanthen-9-oneFormula:
C29H36O17Smiles:
COc1cc(OC2OC(COC3OCC(O)C(O)C3O)C(O)C(O)C2O)c2c(=O)c3c(OC)c(OC)c(OC)c(OC)c3oc2c1Aglycone:
COc1cc(O)c2c(=O)c3c(OC)c(OC)c(OC)c(OC)c3oc2c1Sugarmoiety:
OC1COC(OCC2OC(O)C(O)C(O)C2O)C(O)C1OOther Identifiers
Properties
| HBA: | 17 | RingCount: | 5 |
| HBD: | 6 | FractionCSP3: | 0.55 |
| AlogP: | -1.37 | Num_rotatable_bonds: | 10 |
| MolWt: | 656.59 | Num_heavy_atoms: | 46 |
| TPSA: | 234.66 | NumAromaticRings: | 3 |
Unique Aglycone
AD45665
Formula: C18H18O8
Smiles:
COc1cc(O)c2c(=O)c3c(OC)c(OC)c(OC)c(OC)c3oc2c1| HBA: | 8 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.28 |
| AlogP: | 2.69 | Num_rotatable_bonds: | 5 |
| MolWt: | 362.33 | Num_heavy_atoms: | 26 |
| TPSA: | 96.59 | NumAromaticRings: | 3 |
