Glycoside
GD155615
Name:
4-hydroxy-2-(2-hydroxypropan-2-yl)-7-({[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}methyl)-2H,3H,5H-furo[3,2-g]chromen-5-oneFormula:
C21H26O11Smiles:
CC(C)(O)C1Cc2c(cc3oc(COC4OC(CO)C(O)C(O)C4O)cc(=O)c3c2O)O1Aglycone:
CC(C)(O)C1Cc2c(cc3oc(CO)cc(=O)c3c2O)O1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 4 |
| HBD: | 6 | FractionCSP3: | 0.57 |
| AlogP: | -1.11 | Num_rotatable_bonds: | 5 |
| MolWt: | 454.43 | Num_heavy_atoms: | 32 |
| TPSA: | 179.28 | NumAromaticRings: | 2 |
Unique Aglycone
AD61715
Formula: C15H16O6
Smiles:
CC(C)(O)C1Cc2c(cc3oc(CO)cc(=O)c3c2O)O1| HBA: | 6 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.4 |
| AlogP: | 1.07 | Num_rotatable_bonds: | 2 |
| MolWt: | 292.29 | Num_heavy_atoms: | 21 |
| TPSA: | 100.13 | NumAromaticRings: | 2 |
