Glycoside
GD150793
Name:
6-(1,2-dihydroxyethyl)-8-(2,3,4,5-tetrahydroxypentyl)-1,2,3,4,7,8-hexahydropteridine-2,4,7-trioneFormula:
C13H18O9N4Smiles:
O=c1c(C(O)CO)nc2c(O)nc(O)nc2n1CC(O)C(O)C(O)COAglycone:
Cn1c(=O)c(C(O)CO)nc2c(O)nc(O)nc21Sugarmoiety:
OCC(O)C(O)C(O)OOther Identifiers
Properties
| HBA: | 13 | RingCount: | 2 |
| HBD: | 8 | FractionCSP3: | 0.54 |
| AlogP: | -4.3 | Num_rotatable_bonds: | 7 |
| MolWt: | 374.31 | Num_heavy_atoms: | 26 |
| TPSA: | 222.51 | NumAromaticRings: | 2 |
Unique Aglycone
AD60198
Formula: C9H10O5N4
Smiles:
Cn1c(=O)c(C(O)CO)nc2c(O)nc(O)nc21| HBA: | 9 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.33 |
| AlogP: | -1.84 | Num_rotatable_bonds: | 2 |
| MolWt: | 254.2 | Num_heavy_atoms: | 18 |
| TPSA: | 141.59 | NumAromaticRings: | 2 |
