Glycoside
GD152939
Name:
2-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-5-hydroxy-2,3-dihydro-1,2,4-triazin-3-oneFormula:
C8H11O6N3Smiles:
O=c1nc(O)cnn1C1OC(CO)C(O)C1OAglycone:
O=c1nc(O)cn[nH]1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.62 |
| AlogP: | -3.04 | Num_rotatable_bonds: | 2 |
| MolWt: | 245.19 | Num_heavy_atoms: | 17 |
| TPSA: | 137.93 | NumAromaticRings: | 1 |
Unique Aglycone
AD48589
Formula: C3H3O2N3
Smiles:
O=c1nc(O)cn[nH]1| HBA: | 5 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | -1.13 | Num_rotatable_bonds: | 0 |
| MolWt: | 113.08 | Num_heavy_atoms: | 8 |
| TPSA: | 78.87 | NumAromaticRings: | 1 |
