Glycoside
GD148661
Name:
6,7-dihydroxy-3-(2-hydroxyphenyl)-5-({[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}methyl)-hexahydro-2H-pyrano[2,3-d][1,3]oxazol-2-oneFormula:
C19H25O12NSmiles:
O=C1OC2C(O)C(O)C(COC3OC(CO)C(O)C(O)C3O)OC2N1c1ccccc1OAglycone:
O=C1OC2C(O)C(O)C(CO)OC2N1c1ccccc1OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 13 | RingCount: | 4 |
| HBD: | 7 | FractionCSP3: | 0.63 |
| AlogP: | -3.02 | Num_rotatable_bonds: | 5 |
| MolWt: | 459.4 | Num_heavy_atoms: | 32 |
| TPSA: | 198.84 | NumAromaticRings: | 1 |
Unique Aglycone
AD59479
Formula: C13H15O7N
Smiles:
O=C1OC2C(O)C(O)C(CO)OC2N1c1ccccc1O| HBA: | 8 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.46 |
| AlogP: | -0.84 | Num_rotatable_bonds: | 2 |
| MolWt: | 297.26 | Num_heavy_atoms: | 21 |
| TPSA: | 119.69 | NumAromaticRings: | 1 |
