Glycoside
GD130194
Name:
2-[3,4-dihydroxy-5-({[(propan-2-yl)carbamoyl]amino}methyl)oxolan-2-yl]-N-(propan-2-yl)acetamideFormula:
C14H27O5N3Smiles:
CC(C)N=C(O)CC1OC(CN=C(O)NC(C)C)C(O)C1OAglycone:
CC(O)=NC(C)C.CN=C(O)NC(C)CSugarmoiety:
OC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 1 |
| HBD: | 5 | FractionCSP3: | 0.86 |
| AlogP: | 0.14 | Num_rotatable_bonds: | 6 |
| MolWt: | 317.39 | Num_heavy_atoms: | 22 |
| TPSA: | 126.9 | NumAromaticRings: | 0 |
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 |
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 |
