Glycoside
GD151021
Name:
LyalosideFormula:
C27H30O9N2Smiles:
C=CC1C(OC2OC(CO)C(O)C(O)C2O)OC=C(C(=O)OC)C1Cc1nccc2c1[nH]c1ccccc12Aglycone:
C=CC1C(O)OC=C(C(=O)OC)C1Cc1nccc2c1[nH]c1ccccc12Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 5 |
| HBD: | 5 | FractionCSP3: | 0.41 |
| AlogP: | 0.91 | Num_rotatable_bonds: | 7 |
| MolWt: | 526.54 | Num_heavy_atoms: | 38 |
| TPSA: | 163.59 | NumAromaticRings: | 3 |
Unique Aglycone
AD54119
Formula: C21H20O4N2
Smiles:
C=CC1C(O)OC=C(C(=O)OC)C1Cc1nccc2c1[nH]c1ccccc12| HBA: | 6 | RingCount: | 4 |
| HBD: | 2 | FractionCSP3: | 0.24 |
| AlogP: | 3.08 | Num_rotatable_bonds: | 4 |
| MolWt: | 364.4 | Num_heavy_atoms: | 27 |
| TPSA: | 84.44 | NumAromaticRings: | 3 |
