Glycoside
GD122411
Name:
N-({3,4-dihydroxy-5-[(phenylcarbamoyl)methyl]oxolan-2-yl}methyl)benzamideFormula:
C20H22O5N2Smiles:
OC(CC1OC(CN=C(O)c2ccccc2)C(O)C1O)=Nc1ccccc1Aglycone:
CC(O)=Nc1ccccc1.CN=C(O)c1ccccc1Sugarmoiety:
OC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.3 |
| AlogP: | 2.16 | Num_rotatable_bonds: | 6 |
| MolWt: | 370.41 | Num_heavy_atoms: | 27 |
| TPSA: | 114.87 | NumAromaticRings: | 2 |
Unique Aglycone
AD45684
Formula: C8H9ON
Smiles:
CC(O)=Nc1ccccc1| HBA: | 2 | RingCount: | 1 |
| HBD: | 1 | FractionCSP3: | 0.12 |
| AlogP: | 2.29 | Num_rotatable_bonds: | 1 |
| MolWt: | 135.17 | Num_heavy_atoms: | 10 |
| TPSA: | 32.59 | NumAromaticRings: | 1 |
AD47599
Formula: C8H9ON
Smiles:
CN=C(O)c1ccccc1| HBA: | 2 | RingCount: | 1 |
| HBD: | 1 | FractionCSP3: | 0.12 |
| AlogP: | 1.62 | Num_rotatable_bonds: | 1 |
| MolWt: | 135.17 | Num_heavy_atoms: | 10 |
| TPSA: | 32.59 | NumAromaticRings: | 1 |
