Glycoside
GD123649
Name:
NoneFormula:
C15H26O7N2Smiles:
CC(C)N=C(O)CC1OC(CN=C(O)CCCC(=O)O)C(O)C1OAglycone:
CC(O)=NC(C)C.CN=C(O)CCCC(=O)OSugarmoiety:
OC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 1 |
| HBD: | 5 | FractionCSP3: | 0.8 |
| AlogP: | 0.44 | Num_rotatable_bonds: | 9 |
| MolWt: | 346.38 | Num_heavy_atoms: | 24 |
| TPSA: | 152.17 | 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 |
AD49922
Formula: C6H11O3N
Smiles:
CN=C(O)CCCC(=O)O| HBA: | 4 | RingCount: | 0 |
| HBD: | 2 | FractionCSP3: | 0.67 |
| AlogP: | 0.83 | Num_rotatable_bonds: | 4 |
| MolWt: | 145.16 | Num_heavy_atoms: | 10 |
| TPSA: | 69.89 | NumAromaticRings: | 0 |
