Glycoside
GD139464
Name:
3,4,5-trihydroxy-6-[(2-phenylethyl)amino]oxane-2-carboxylic acidFormula:
C14H19O6NSmiles:
O=C(O)C1OC(NCCc2ccccc2)C(O)C(O)C1OAglycone:
NCCc1ccccc1Sugarmoiety:
O=C(O)C1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.5 |
| AlogP: | -1.29 | Num_rotatable_bonds: | 5 |
| MolWt: | 297.31 | Num_heavy_atoms: | 21 |
| TPSA: | 119.25 | NumAromaticRings: | 1 |
Unique Aglycone
AD08158
Formula: C8H11N
Smiles:
NCCc1ccccc1| HBA: | 1 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.25 |
| AlogP: | 1.19 | Num_rotatable_bonds: | 2 |
| MolWt: | 121.18 | Num_heavy_atoms: | 9 |
| TPSA: | 26.02 | NumAromaticRings: | 1 |
