Glycoside
GD144377
Name:
2-[3,4-dihydroxy-5-({[(propan-2-yl)carbamoyl]amino}methyl)oxolan-2-yl]-N-[2-(dimethylamino)ethyl]acetamideFormula:
C15H30O5N4Smiles:
CC(C)NC(O)=NCC1OC(CC(O)=NCCN(C)C)C(O)C1OAglycone:
CC(O)=NCCN(C)C.CN=C(O)NC(C)CSugarmoiety:
OC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 1 |
| HBD: | 5 | FractionCSP3: | 0.87 |
| AlogP: | -0.7 | Num_rotatable_bonds: | 8 |
| MolWt: | 346.43 | Num_heavy_atoms: | 24 |
| TPSA: | 130.14 | NumAromaticRings: | 0 |
Unique Aglycone
AD45401
Formula: C6H14ON2
Smiles:
CC(O)=NCCN(C)C| HBA: | 3 | RingCount: | 0 |
| HBD: | 1 | FractionCSP3: | 0.83 |
| AlogP: | 0.52 | Num_rotatable_bonds: | 3 |
| MolWt: | 130.19 | Num_heavy_atoms: | 9 |
| TPSA: | 35.83 | NumAromaticRings: | 0 |
AD46637
Formula: C5H12ON2
Smiles:
CN=C(O)NC(C)C| HBA: | 3 | RingCount: | 0 |
| HBD: | 2 | FractionCSP3: | 0.8 |
| AlogP: | 0.53 | Num_rotatable_bonds: | 1 |
| MolWt: | 116.16 | Num_heavy_atoms: | 8 |
| TPSA: | 44.62 | NumAromaticRings: | 0 |
