Glycoside
GD153573
Name:
2-{[2-(hex-3-en-1-yloxy)-5-hydroxy-6-(hydroxymethyl)-3-[(3,4,5-trihydroxyoxan-2-yl)oxy]oxan-4-yl]oxy}-6-(hydroxymethyl)oxane-3,4,5-triolFormula:
C23H40O15Smiles:
CCC=CCCOC1OC(CO)C(O)C(OC2OC(CO)C(O)C(O)C2O)C1OC1OCC(O)C(O)C1OAglycone:
CCC=CCCOSugarmoiety:
OCC1OC(OC2C(O)C(CO)OC(O)C2OC2OCC(O)C(O)C2O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 15 | RingCount: | 3 |
| HBD: | 9 | FractionCSP3: | 0.91 |
| AlogP: | -4.55 | Num_rotatable_bonds: | 11 |
| MolWt: | 556.56 | Num_heavy_atoms: | 38 |
| TPSA: | 237.45 | NumAromaticRings: | 0 |
Unique Aglycone
AD11558
Formula: C6H12O
Smiles:
CCC=CCCO| HBA: | 1 | RingCount: | 0 |
| HBD: | 1 | FractionCSP3: | 0.67 |
| AlogP: | 1.33 | Num_rotatable_bonds: | 3 |
| MolWt: | 100.16 | Num_heavy_atoms: | 7 |
| TPSA: | 20.23 | NumAromaticRings: | 0 |
