Glycoside
GD153547
Name:
5-ethyl-2-(hydroxymethyl)-3-[3,4,5-trihydroxy-5-(hydroxymethyl)oxolane-2-carbonyloxy]-3aH-indol-3a-ideFormula:
C17H20O8NSmiles:
CCc1ccc2[n-]c(CO)c(OC(=O)C3OC(O)(CO)C(O)C3O)c2c1Aglycone:
CCc1ccc2[n-]c(CO)c(OC=O)c2c1Sugarmoiety:
OCC1(O)OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.47 |
| AlogP: | -1.44 | Num_rotatable_bonds: | 5 |
| MolWt: | 366.35 | Num_heavy_atoms: | 26 |
| TPSA: | 150.78 | NumAromaticRings: | 2 |
Unique Aglycone
AD61052
Formula: C12H12O3N
Smiles:
CCc1ccc2[n-]c(CO)c(OC=O)c2c1| HBA: | 4 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.25 |
| AlogP: | 1.39 | Num_rotatable_bonds: | 4 |
| MolWt: | 218.23 | Num_heavy_atoms: | 16 |
| TPSA: | 60.63 | NumAromaticRings: | 2 |
