Glycoside
GD122920
Name:
Cussoside CFormula:
C31H52O12Smiles:
CC1=CCCC2C1(COC1OC(CO)C(O)C(O)C1O)CCC(C)C2(C)CCC(=CCOC1OCC(O)(CO)C1O)COAglycone:
CC1=CCCC2C1(CO)CCC(C)C2(C)CCC(=CCO)COSugarmoiety:
OCC1(O)COC(O)C1O.OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 4 |
| HBD: | 8 | FractionCSP3: | 0.87 |
| AlogP: | -0.26 | Num_rotatable_bonds: | 12 |
| MolWt: | 616.75 | Num_heavy_atoms: | 43 |
| TPSA: | 198.76 | NumAromaticRings: | 0 |
Unique Aglycone
AD49579
Formula: C20H34O3
Smiles:
CC1=CCCC2C1(CO)CCC(C)C2(C)CCC(=CCO)CO| HBA: | 3 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.8 |
| AlogP: | 3.45 | Num_rotatable_bonds: | 6 |
| MolWt: | 322.49 | Num_heavy_atoms: | 23 |
| TPSA: | 60.69 | NumAromaticRings: | 0 |
