Glycoside
GD153808
Name:
Enteridinine AFormula:
C34H60O13Smiles:
CCC(O)C(C)C1OC2(OC(C(C)C(=O)OC3CC(O)C(OC4CC(C)(O)C(O)C(C)O4)C(C)O3)C(C)C(O)C2C)C(C)C(O)C1CAglycone:
CCC(O)C(C)C1OC2(OC(C(C)C(=O)O)C(C)C(O)C2C)C(C)C(O)C1CSugarmoiety:
CC1OC(O)CC(O)C1OC1CC(C)(O)C(O)C(C)O1Other Identifiers
Properties
| HBA: | 13 | RingCount: | 4 |
| HBD: | 6 | FractionCSP3: | 0.97 |
| AlogP: | 1.46 | Num_rotatable_bonds: | 8 |
| MolWt: | 676.84 | Num_heavy_atoms: | 47 |
| TPSA: | 193.83 | NumAromaticRings: | 0 |
Unique Aglycone
AD47051
Formula: C21H38O7
Smiles:
CCC(O)C(C)C1OC2(OC(C(C)C(=O)O)C(C)C(O)C2C)C(C)C(O)C1C| HBA: | 7 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.95 |
| AlogP: | 1.87 | Num_rotatable_bonds: | 5 |
| MolWt: | 402.53 | Num_heavy_atoms: | 28 |
| TPSA: | 116.45 | NumAromaticRings: | 0 |
