Glycoside
GD149389
Name:
N-benzyl-2-(3,4-dihydroxy-5-{[(phenylcarbamoyl)amino]methyl}oxolan-2-yl)-N-methylacetamideFormula:
C22H27O5N3Smiles:
CN(Cc1ccccc1)C(=O)CC1OC(CN=C(O)Nc2ccccc2)C(O)C1OAglycone:
CC(=O)N(C)Cc1ccccc1.CN=C(O)Nc1ccccc1Sugarmoiety:
OC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.36 |
| AlogP: | 1.55 | Num_rotatable_bonds: | 7 |
| MolWt: | 413.47 | Num_heavy_atoms: | 30 |
| TPSA: | 114.62 | NumAromaticRings: | 2 |
Unique Aglycone
AD19490
Formula: C10H13ON
Smiles:
CC(=O)N(C)Cc1ccccc1| HBA: | 2 | RingCount: | 1 |
| HBD: | 0 | FractionCSP3: | 0.3 |
| AlogP: | 1.66 | Num_rotatable_bonds: | 2 |
| MolWt: | 163.22 | Num_heavy_atoms: | 12 |
| TPSA: | 20.31 | NumAromaticRings: | 1 |
AD46818
Formula: C8H10ON2
Smiles:
CN=C(O)Nc1ccccc1| HBA: | 3 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.12 |
| AlogP: | 1.64 | Num_rotatable_bonds: | 1 |
| MolWt: | 150.18 | Num_heavy_atoms: | 11 |
| TPSA: | 44.62 | NumAromaticRings: | 1 |
