Glycoside
GD034374
Name:
NoneFormula:
C12H20O11N6P2Smiles:
NCCOP(=O)(O)OP(=O)(O)OC[C@@H]1O[C@H](n2cnc3c(O)nc(N)nc32)[C@H](O)[C@H]1OAglycone:
COP(=O)(O)OP(=O)(O)OCCN.Nc1nc(O)c2c(n1)[N]C=N2Sugarmoiety:
OC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 17 | RingCount: | 3 |
| HBD: | 9 | FractionCSP3: | 0.58 |
| AlogP: | -2.06 | Num_rotatable_bonds: | 9 |
| MolWt: | 486.27 | Num_heavy_atoms: | 31 |
| TPSA: | 267.85 | NumAromaticRings: | 2 |
Unique Aglycone
AD00080
Formula: C5H4ON5
Smiles:
Nc1nc(O)c2c(n1)[N]C=N2| HBA: | 6 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.0 |
| AlogP: | -0.33 | Num_rotatable_bonds: | 0 |
| MolWt: | 150.12 | Num_heavy_atoms: | 11 |
| TPSA: | 98.49 | NumAromaticRings: | 1 |
AD21860
Formula: C3H11O7NP2
Smiles:
COP(=O)(O)OP(=O)(O)OCCN| HBA: | 8 | RingCount: | 0 |
| HBD: | 4 | FractionCSP3: | 1.0 |
| AlogP: | -0.17 | Num_rotatable_bonds: | 6 |
| MolWt: | 235.07 | Num_heavy_atoms: | 13 |
| TPSA: | 128.31 | NumAromaticRings: | 0 |
