Glycoside
GD124439
Name:
Charantoside CFormula:
C37H58O9Smiles:
COC(C)(C)C=CCC(C)C1CCC2(C)C3C=CC45OC(=O)C3(CCC12C)C4CCC(OC1OC(CO)C(O)C(O)C1O)C5(C)CAglycone:
COC(C)(C)C=CCC(C)C1CCC2(C)C3C=CC45OC(=O)C3(CCC12C)C4CCC(O)C5(C)CSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 6 |
| HBD: | 4 | FractionCSP3: | 0.86 |
| AlogP: | 4.3 | Num_rotatable_bonds: | 8 |
| MolWt: | 646.86 | Num_heavy_atoms: | 46 |
| TPSA: | 134.91 | NumAromaticRings: | 0 |
Unique Aglycone
AD50267
Formula: C31H48O4
Smiles:
COC(C)(C)C=CCC(C)C1CCC2(C)C3C=CC45OC(=O)C3(CCC12C)C4CCC(O)C5(C)C| HBA: | 4 | RingCount: | 5 |
| HBD: | 1 | FractionCSP3: | 0.84 |
| AlogP: | 6.48 | Num_rotatable_bonds: | 5 |
| MolWt: | 484.72 | Num_heavy_atoms: | 35 |
| TPSA: | 55.76 | NumAromaticRings: | 0 |
