Glycoside
GD125545
Name:
Linckoside KFormula:
C39H64O14Smiles:
COC1C(OC2C=C3C(O)CC4(O)C(CCC5(C)C(C(C)C=CC(COC6OC(CO)C(O)C6O)C(C)C)C(O)C(O)C54)C3(C)CC2)OCC(O)C1OAglycone:
CC(C)C(C=CC(C)C1C(O)C(O)C2C1(C)CCC1C3(C)CCC(O)C=C3C(O)CC12O)COSugarmoiety:
COC1C(O)OCC(O)C1O.OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 14 | RingCount: | 6 |
| HBD: | 9 | FractionCSP3: | 0.9 |
| AlogP: | -0.01 | Num_rotatable_bonds: | 11 |
| MolWt: | 756.93 | Num_heavy_atoms: | 53 |
| TPSA: | 228.22 | NumAromaticRings: | 0 |
Unique Aglycone
AD50777
Formula: C28H46O6
Smiles:
CC(C)C(C=CC(C)C1C(O)C(O)C2C1(C)CCC1C3(C)CCC(O)C=C3C(O)CC12O)CO| HBA: | 6 | RingCount: | 4 |
| HBD: | 6 | FractionCSP3: | 0.86 |
| AlogP: | 2.41 | Num_rotatable_bonds: | 5 |
| MolWt: | 478.67 | Num_heavy_atoms: | 34 |
| TPSA: | 121.38 | NumAromaticRings: | 0 |
