Glycoside
GD028250
Name:
NoneFormula:
C22H18O4N8Br4Smiles:
OCC(O)C(O)C(O)C(C=NNc1ncnc2c(Br)cc(Br)cc12)=NNc1ncnc2c(Br)cc(Br)cc12Aglycone:
Brc1cc(Br)c2ncnc(NN=CC=NNc3ncnc4c(Br)cc(Br)cc34)c2c1Sugarmoiety:
OCC(O)C(O)C(O)OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 4 |
| HBD: | 6 | FractionCSP3: | 0.18 |
| AlogP: | 3.56 | Num_rotatable_bonds: | 9 |
| MolWt: | 778.05 | Num_heavy_atoms: | 38 |
| TPSA: | 181.26 | NumAromaticRings: | 4 |
Unique Aglycone
AD18484
Formula: C18H10N8Br4
Smiles:
Brc1cc(Br)c2ncnc(NN=CC=NNc3ncnc4c(Br)cc(Br)cc34)c2c1| HBA: | 8 | RingCount: | 4 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | 6.12 | Num_rotatable_bonds: | 5 |
| MolWt: | 657.95 | Num_heavy_atoms: | 30 |
| TPSA: | 100.34 | NumAromaticRings: | 4 |
