Glycoside
GD148895
Name:
6-[3-(2-amino-4-oxo-3,4-dihydropteridin-6-yl)-2,3-dihydroxypropoxy]-3,4,5-trihydroxyoxane-2-carboxylic acidFormula:
C15H19O10N5Smiles:
N=c1nc(O)c2nc(C(O)C(O)COC3OC(C(=O)O)C(O)C(O)C3O)cnc2[nH]1Aglycone:
N=c1nc(O)c2nc(C(O)C(O)CO)cnc2[nH]1Sugarmoiety:
O=C(O)C1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 15 | RingCount: | 3 |
| HBD: | 9 | FractionCSP3: | 0.53 |
| AlogP: | -4.16 | Num_rotatable_bonds: | 6 |
| MolWt: | 429.34 | Num_heavy_atoms: | 30 |
| TPSA: | 255.45 | NumAromaticRings: | 2 |
Unique Aglycone
AD57688
Formula: C9H11O4N5
Smiles:
N=c1nc(O)c2nc(C(O)C(O)CO)cnc2[nH]1| HBA: | 9 | RingCount: | 2 |
| HBD: | 6 | FractionCSP3: | 0.33 |
| AlogP: | -2.08 | Num_rotatable_bonds: | 3 |
| MolWt: | 253.22 | Num_heavy_atoms: | 18 |
| TPSA: | 159.23 | NumAromaticRings: | 2 |
