Glycoside
GD115246
Name:
6-[4-(2-aminoethyl)phenoxy]-3,4,5-trihydroxyoxane-2-carboxylic acidFormula:
C14H19O7NSmiles:
NCCc1ccc(OC2OC(C(=O)O)C(O)C(O)C2O)cc1Aglycone:
NCCc1ccc(O)cc1Sugarmoiety:
O=C(O)C1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 2 |
| HBD: | 6 | FractionCSP3: | 0.5 |
| AlogP: | -1.54 | Num_rotatable_bonds: | 5 |
| MolWt: | 313.31 | Num_heavy_atoms: | 22 |
| TPSA: | 142.47 | NumAromaticRings: | 1 |
Unique Aglycone
AD45550
Formula: C8H11ON
Smiles:
NCCc1ccc(O)cc1| HBA: | 2 | RingCount: | 1 |
| HBD: | 3 | FractionCSP3: | 0.25 |
| AlogP: | 0.89 | Num_rotatable_bonds: | 2 |
| MolWt: | 137.18 | Num_heavy_atoms: | 10 |
| TPSA: | 46.25 | NumAromaticRings: | 1 |
