Glycoside
GD127681
Name:
Lemmonin CFormula:
C21H32O8Smiles:
C=C1CC2OC(=O)C(C)C2CC2C1CCC2(C)OC1OC(CO)C(O)C(O)C1OAglycone:
C=C1CC2OC(=O)C(C)C2CC2C1CCC2(C)OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.86 |
| AlogP: | 0.12 | Num_rotatable_bonds: | 3 |
| MolWt: | 412.48 | Num_heavy_atoms: | 29 |
| TPSA: | 125.68 | NumAromaticRings: | 0 |
Unique Aglycone
AD51705
Formula: C15H22O3
Smiles:
C=C1CC2OC(=O)C(C)C2CC2C1CCC2(C)O| HBA: | 3 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.8 |
| AlogP: | 2.29 | Num_rotatable_bonds: | 0 |
| MolWt: | 250.34 | Num_heavy_atoms: | 18 |
| TPSA: | 46.53 | NumAromaticRings: | 0 |
