Glycoside
GD131957
Name:
1-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-1H,4aH,5H,6H,7H,7aH-cyclopenta[c]pyran-4a,5,6,7-tetrolFormula:
C14H22O11Smiles:
OCC1OC(OC2OC=CC3(O)C(O)C(O)C(O)C23)C(O)C(O)C1OAglycone:
OC1OC=CC2(O)C(O)C(O)C(O)C12Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 3 |
| HBD: | 8 | FractionCSP3: | 0.86 |
| AlogP: | -4.88 | Num_rotatable_bonds: | 3 |
| MolWt: | 366.32 | Num_heavy_atoms: | 25 |
| TPSA: | 189.53 | NumAromaticRings: | 0 |
Unique Aglycone
AD53430
Formula: C8H12O6
Smiles:
OC1OC=CC2(O)C(O)C(O)C(O)C12| HBA: | 6 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.75 |
| AlogP: | -2.71 | Num_rotatable_bonds: | 0 |
| MolWt: | 204.18 | Num_heavy_atoms: | 14 |
| TPSA: | 110.38 | NumAromaticRings: | 0 |
