Glycoside
GD153113
Name:
Udp-L-Threo-4-PentosuloseFormula:
C14H18O10N2Smiles:
O=C1COC(OCC2OC(n3ccc(O)nc3=O)C(O)C2O)C(O)C1OAglycone:
COC1OCC(=O)C(O)C1O.O=c1nc(O)cc[nH]1Sugarmoiety:
OC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.64 |
| AlogP: | -3.77 | Num_rotatable_bonds: | 4 |
| MolWt: | 374.3 | Num_heavy_atoms: | 26 |
| TPSA: | 180.8 | NumAromaticRings: | 1 |
Unique Aglycone
AD15478
Formula: C4H4O2N2
Smiles:
O=c1nc(O)cc[nH]1| HBA: | 4 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | -0.52 | Num_rotatable_bonds: | 0 |
| MolWt: | 112.09 | Num_heavy_atoms: | 8 |
| TPSA: | 65.98 | NumAromaticRings: | 1 |
AD60922
Formula: C6H10O5
Smiles:
COC1OCC(=O)C(O)C1O| HBA: | 5 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.83 |
| AlogP: | -1.72 | Num_rotatable_bonds: | 1 |
| MolWt: | 162.14 | Num_heavy_atoms: | 11 |
| TPSA: | 75.99 | NumAromaticRings: | 0 |
