Glycoside
GD147027
Name:
4-{[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]oxy}-2-methyl-3,4,5,6-tetrahydropyrimidine-4-carboxylic acidFormula:
C11H18O7N2Smiles:
CC1=NCCC(OC2OC(CO)C(O)C2O)(C(=O)O)N1Aglycone:
CC1=NCCC(O)(C(=O)O)N1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.82 |
| AlogP: | -2.37 | Num_rotatable_bonds: | 4 |
| MolWt: | 290.27 | Num_heavy_atoms: | 20 |
| TPSA: | 140.84 | NumAromaticRings: | 0 |
Unique Aglycone
AD58897
Formula: C6H10O3N2
Smiles:
CC1=NCCC(O)(C(=O)O)N1| HBA: | 5 | RingCount: | 1 |
| HBD: | 3 | FractionCSP3: | 0.67 |
| AlogP: | -0.83 | Num_rotatable_bonds: | 1 |
| MolWt: | 158.16 | Num_heavy_atoms: | 11 |
| TPSA: | 81.92 | NumAromaticRings: | 0 |
