Glycoside
GD156095
Name:
5-methoxy-8,8-dimethyl-2-({[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}methyl)-4H,8H-pyrano[2,3-h]chromen-4-oneFormula:
C22H26O10Smiles:
COc1cc2c(c3oc(COC4OC(CO)C(O)C(O)C4O)cc(=O)c13)C=CC(C)(C)O2Aglycone:
COc1cc2c(c3oc(CO)cc(=O)c13)C=CC(C)(C)O2Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.5 |
| AlogP: | 0.3 | Num_rotatable_bonds: | 5 |
| MolWt: | 450.44 | Num_heavy_atoms: | 32 |
| TPSA: | 148.05 | NumAromaticRings: | 2 |
Unique Aglycone
AD61844
Formula: C16H16O5
Smiles:
COc1cc2c(c3oc(CO)cc(=O)c13)C=CC(C)(C)O2| HBA: | 5 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.31 |
| AlogP: | 2.48 | Num_rotatable_bonds: | 2 |
| MolWt: | 288.3 | Num_heavy_atoms: | 21 |
| TPSA: | 68.9 | NumAromaticRings: | 2 |
