Glycoside
GD148626
Name:
2-({6-chloro-5,7-dihydroxy-1H,4aH,5H,6H,7H,7aH-cyclopenta[c]pyran-1-yl}oxy)-6-(hydroxymethyl)oxane-3,4,5-triolFormula:
C15H21O9ClSmiles:
OCC1OC(OC2OC=CC3C(O)C(Cl)C(O)C23)C(O)C(O)C1OAglycone:
OC1OC=CC2C(O)C(Cl)C(O)C12Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.86 |
| AlogP: | -2.75 | Num_rotatable_bonds: | 3 |
| MolWt: | 368.77 | Num_heavy_atoms: | 24 |
| TPSA: | 149.07 | NumAromaticRings: | 0 |
Unique Aglycone
AD59460
Formula: C9H11O4Cl
Smiles:
OC1OC=CC2C(O)C(Cl)C(O)C12| HBA: | 4 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.75 |
| AlogP: | -0.58 | Num_rotatable_bonds: | 0 |
| MolWt: | 206.62 | Num_heavy_atoms: | 13 |
| TPSA: | 69.92 | NumAromaticRings: | 0 |
