Glycoside
GD001728
Name:
NoneFormula:
C17H29O10N6PSmiles:
COC(=O)[C@H](C)NP(=O)(N[C@H](C)C(=O)OC)OC[C@@H]1O[C@H](n2cnc(C(N)=O)c2N)[C@H](O)[C@H]1OAglycone:
COC(=O)C(C)NP(=O)(NC(C)C(=O)OC)OC.NC(=O)C1=C(N)[N]C=N1Sugarmoiety:
OC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 16 | RingCount: | 2 |
| HBD: | 8 | FractionCSP3: | 0.65 |
| AlogP: | -2.39 | Num_rotatable_bonds: | 11 |
| MolWt: | 508.43 | Num_heavy_atoms: | 34 |
| TPSA: | 239.58 | NumAromaticRings: | 1 |
Unique Aglycone
AD01699
Formula: C9H19O6N2P
Smiles:
COC(=O)C(C)NP(=O)(NC(C)C(=O)OC)OC| HBA: | 8 | RingCount: | 0 |
| HBD: | 2 | FractionCSP3: | 0.78 |
| AlogP: | 0.04 | Num_rotatable_bonds: | 7 |
| MolWt: | 282.23 | Num_heavy_atoms: | 18 |
| TPSA: | 102.96 | NumAromaticRings: | 0 |
AD01700
Formula: C4H5ON4
Smiles:
NC(=O)C1=C(N)[N]C=N1| HBA: | 5 | RingCount: | 1 |
| HBD: | 4 | FractionCSP3: | 0.0 |
| AlogP: | -1.75 | Num_rotatable_bonds: | 1 |
| MolWt: | 125.11 | Num_heavy_atoms: | 9 |
| TPSA: | 95.57 | NumAromaticRings: | 0 |
