Glycoside
GD143423
Name:
5-amino-6-[2,3-dihydroxy-3-(4-hydroxy-2-imino-1,2-dihydropteridin-6-yl)propoxy]-2-(hydroxymethyl)oxane-3,4-diolFormula:
C15H22O8N6Smiles:
N=c1nc(O)c2nc(C(O)C(O)COC3OC(CO)C(O)C(O)C3N)cnc2[nH]1Aglycone:
N=c1nc(O)c2nc(C(O)C(O)CO)cnc2[nH]1Sugarmoiety:
NC1C(O)OC(CO)C(O)C1OOther Identifiers
Properties
| HBA: | 14 | RingCount: | 3 |
| HBD: | 10 | FractionCSP3: | 0.6 |
| AlogP: | -4.28 | Num_rotatable_bonds: | 6 |
| MolWt: | 414.38 | Num_heavy_atoms: | 29 |
| TPSA: | 244.17 | 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 |
