Glycoside
GD138077
Name:
Ixerin NFormula:
C27H38O11Smiles:
C=C1CC(OC(=O)C(O)C(C)CC)C2C(=C)C(=O)OC2C2C(=C)C(OC3OC(CO)C(O)C(O)C3O)CC12Aglycone:
C=C1CC(OC(=O)C(O)C(C)CC)C2C(=C)C(=O)OC2C2C(=C)C(O)CC12Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.7 |
| AlogP: | -0.26 | Num_rotatable_bonds: | 7 |
| MolWt: | 538.59 | Num_heavy_atoms: | 38 |
| TPSA: | 172.21 | NumAromaticRings: | 0 |
Unique Aglycone
AD52845
Formula: C21H28O6
Smiles:
C=C1CC(OC(=O)C(O)C(C)CC)C2C(=C)C(=O)OC2C2C(=C)C(O)CC12| HBA: | 6 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.62 |
| AlogP: | 1.92 | Num_rotatable_bonds: | 4 |
| MolWt: | 376.45 | Num_heavy_atoms: | 27 |
| TPSA: | 93.06 | NumAromaticRings: | 0 |
