Glycoside
GD140081
Name:
2-(3,4-dihydroxy-5-{[(phenylcarbamoyl)amino]methyl}oxolan-2-yl)-N-(propan-2-yl)acetamideFormula:
C17H25O5N3Smiles:
CC(C)N=C(O)CC1OC(CN=C(O)Nc2ccccc2)C(O)C1OAglycone:
CC(O)=NC(C)C.CN=C(O)Nc1ccccc1Sugarmoiety:
OC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.53 |
| AlogP: | 1.26 | Num_rotatable_bonds: | 6 |
| MolWt: | 351.4 | Num_heavy_atoms: | 25 |
| TPSA: | 126.9 | NumAromaticRings: | 1 |
Unique Aglycone
AD45654
Formula: C5H11ON
Smiles:
CC(O)=NC(C)C| HBA: | 2 | RingCount: | 0 |
| HBD: | 1 | FractionCSP3: | 0.8 |
| AlogP: | 1.37 | Num_rotatable_bonds: | 1 |
| MolWt: | 101.15 | Num_heavy_atoms: | 7 |
| TPSA: | 32.59 | NumAromaticRings: | 0 |
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 |
