Glycoside
GD123339
Name:
5-(2-bromoethenyl)-1-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-1,2,3,4-tetrahydropyrimidine-2,4-dioneFormula:
C11H13O6N2BrSmiles:
O=c1nc(O)c(C=CBr)cn1C1OC(CO)C(O)C1OAglycone:
O=c1nc(O)c(C=CBr)c[nH]1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.45 |
| AlogP: | -1.07 | Num_rotatable_bonds: | 3 |
| MolWt: | 349.14 | Num_heavy_atoms: | 20 |
| TPSA: | 125.04 | NumAromaticRings: | 1 |
Unique Aglycone
AD49764
Formula: C6H5O2N2Br
Smiles:
O=c1nc(O)c(C=CBr)c[nH]1| HBA: | 4 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | 0.84 | Num_rotatable_bonds: | 1 |
| MolWt: | 217.02 | Num_heavy_atoms: | 11 |
| TPSA: | 65.98 | NumAromaticRings: | 1 |
