Glycoside
GD153992
Name:
Tricalysioside JFormula:
C26H42O10Smiles:
CC1(C=O)C(O)CCC2(C)C1CCC13CC(CCC21)C(O)(COC1OC(CO)C(O)C(O)C1O)C3OAglycone:
CC1(C=O)C(O)CCC2(C)C1CCC13CC(CCC21)C(O)(CO)C3OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 5 |
| HBD: | 7 | FractionCSP3: | 0.96 |
| AlogP: | -0.91 | Num_rotatable_bonds: | 5 |
| MolWt: | 514.61 | Num_heavy_atoms: | 36 |
| TPSA: | 177.14 | NumAromaticRings: | 0 |
Unique Aglycone
AD61202
Formula: C20H32O5
Smiles:
CC1(C=O)C(O)CCC2(C)C1CCC13CC(CCC21)C(O)(CO)C3O| HBA: | 5 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.95 |
| AlogP: | 1.26 | Num_rotatable_bonds: | 2 |
| MolWt: | 352.47 | Num_heavy_atoms: | 25 |
| TPSA: | 97.99 | NumAromaticRings: | 0 |
