Glycoside
GD148243
Name:
1-methyl-5-({[2,4,5-trihydroxy-6-(hydroxymethyl)oxan-3-yl]amino}methylidene)-1,3-diazinane-2,4,6-trioneFormula:
C12H17O8N3Smiles:
CN1C(=O)N=C(O)C(=CNC2C(O)OC(CO)C(O)C2O)C1=OAglycone:
CN1C(=O)N=C(O)C(=CN)C1=OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 2 |
| HBD: | 6 | FractionCSP3: | 0.58 |
| AlogP: | -3.19 | Num_rotatable_bonds: | 3 |
| MolWt: | 331.28 | Num_heavy_atoms: | 23 |
| TPSA: | 172.15 | NumAromaticRings: | 0 |
Unique Aglycone
AD59329
Formula: C6H7O3N3
Smiles:
CN1C(=O)N=C(O)C(=CN)C1=O| HBA: | 6 | RingCount: | 1 |
| HBD: | 3 | FractionCSP3: | 0.17 |
| AlogP: | -0.62 | Num_rotatable_bonds: | 0 |
| MolWt: | 169.14 | Num_heavy_atoms: | 12 |
| TPSA: | 95.99 | NumAromaticRings: | 0 |
