Glycoside
GD143744
Name:
Ent-14-Labden-8Beta-Ol 13Alpha-O-Beta-D-Glucopyranosyl-19-O-Alpha-L-Rhamn+Formula:
C32H56O12Smiles:
C=CC(C)(CCC1C(C)(O)CCC2C(C)(COC3OC(C)C(O)C(O)C3O)CCCC12C)OC1OC(CO)C(O)C(O)C1OAglycone:
C=CC(C)(O)CCC1C(C)(O)CCC2C(C)(CO)CCCC12CSugarmoiety:
CC1OC(O)C(O)C(O)C1O.OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 4 |
| HBD: | 8 | FractionCSP3: | 0.94 |
| AlogP: | 0.35 | Num_rotatable_bonds: | 10 |
| MolWt: | 632.79 | Num_heavy_atoms: | 44 |
| TPSA: | 198.76 | NumAromaticRings: | 0 |
Unique Aglycone
AD53590
Formula: C20H36O3
Smiles:
C=CC(C)(O)CCC1C(C)(O)CCC2C(C)(CO)CCCC12C| HBA: | 3 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.9 |
| AlogP: | 3.67 | Num_rotatable_bonds: | 5 |
| MolWt: | 324.51 | Num_heavy_atoms: | 23 |
| TPSA: | 60.69 | NumAromaticRings: | 0 |
