Glycoside
GD140070
Name:
2-{[5,7-dihydroxy-7-(hydroxymethyl)-1H,4aH,5H,6H,7H,7aH-cyclopenta[c]pyran-1-yl]oxy}-6-(hydroxymethyl)oxane-3,4,5-triolFormula:
C15H24O10Smiles:
OCC1OC(OC2OC=CC3C(O)CC(O)(CO)C23)C(O)C(O)C1OAglycone:
OCC1(O)CC(O)C2C=COC(O)C21Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 7 | FractionCSP3: | 0.87 |
| AlogP: | -3.61 | Num_rotatable_bonds: | 4 |
| MolWt: | 364.35 | Num_heavy_atoms: | 25 |
| TPSA: | 169.3 | NumAromaticRings: | 0 |
Unique Aglycone
AD56475
Formula: C9H14O5
Smiles:
OCC1(O)CC(O)C2C=COC(O)C21| HBA: | 5 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.78 |
| AlogP: | -1.43 | Num_rotatable_bonds: | 1 |
| MolWt: | 202.21 | Num_heavy_atoms: | 14 |
| TPSA: | 90.15 | NumAromaticRings: | 0 |
