Glycoside
GD127711
Name:
2-{[4,5-dihydroxy-2-(hydroxymethyl)-6-[(4-methoxyphenyl)amino]oxan-3-yl]oxy}-6-(hydroxymethyl)oxane-3,4,5-triolFormula:
C19H29O11NSmiles:
COc1ccc(NC2OC(CO)C(OC3OC(CO)C(O)C(O)C3O)C(O)C2O)cc1Aglycone:
COc1ccc(N)cc1Sugarmoiety:
OCC1OC(OC2C(CO)OC(O)C(O)C2O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 3 |
| HBD: | 8 | FractionCSP3: | 0.68 |
| AlogP: | -3.27 | Num_rotatable_bonds: | 7 |
| MolWt: | 447.44 | Num_heavy_atoms: | 31 |
| TPSA: | 190.56 | NumAromaticRings: | 1 |
Unique Aglycone
AD22048
Formula: C7H9ON
Smiles:
COc1ccc(N)cc1| HBA: | 2 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.14 |
| AlogP: | 1.28 | Num_rotatable_bonds: | 1 |
| MolWt: | 123.15 | Num_heavy_atoms: | 9 |
| TPSA: | 35.25 | NumAromaticRings: | 1 |
