Glycoside
GD137926
Name:
3-(hydroxymethyl)-4-(1-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}but-2-en-2-yl)-5,6-dihydro-2H-pyran-2-oneFormula:
C16H24O9Smiles:
CC=C(COC1OC(CO)C(O)C(O)C1O)C1=C(CO)C(=O)OCC1Aglycone:
CC=C(CO)C1=C(CO)C(=O)OCC1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.69 |
| AlogP: | -2.01 | Num_rotatable_bonds: | 6 |
| MolWt: | 360.36 | Num_heavy_atoms: | 25 |
| TPSA: | 145.91 | NumAromaticRings: | 0 |
Unique Aglycone
AD55698
Formula: C10H14O4
Smiles:
CC=C(CO)C1=C(CO)C(=O)OCC1| HBA: | 4 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.5 |
| AlogP: | 0.16 | Num_rotatable_bonds: | 3 |
| MolWt: | 198.22 | Num_heavy_atoms: | 14 |
| TPSA: | 66.76 | NumAromaticRings: | 0 |
