Glycoside
GD131460
Name:
5-ethyl-3-[3,4,5-trihydroxy-5-(hydroxymethyl)oxolane-2-carbonyloxy]-3aH-indol-3a-ideFormula:
C16H18O7NSmiles:
CCc1ccc2[n-]cc(OC(=O)C3OC(O)(CO)C(O)C3O)c2c1Aglycone:
CCc1ccc2[n-]cc(OC=O)c2c1Sugarmoiety:
OCC1(O)OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.44 |
| AlogP: | -0.93 | Num_rotatable_bonds: | 4 |
| MolWt: | 336.32 | Num_heavy_atoms: | 24 |
| TPSA: | 130.55 | NumAromaticRings: | 2 |
Unique Aglycone
AD53258
Formula: C11H10O2N
Smiles:
CCc1ccc2[n-]cc(OC=O)c2c1| HBA: | 3 | RingCount: | 2 |
| HBD: | 0 | FractionCSP3: | 0.18 |
| AlogP: | 1.89 | Num_rotatable_bonds: | 3 |
| MolWt: | 188.21 | Num_heavy_atoms: | 14 |
| TPSA: | 40.4 | NumAromaticRings: | 2 |
