Glycoside
GD024165
Name:
NoneFormula:
C9H10O5N5BrSmiles:
[N-]=[N+]=NC[C@@H]1O[C@H](n2cc(Br)c(=O)[nH]c2=O)[C@H](O)[C@H]1OAglycone:
O=c1[nH]cc(Br)c(=O)[nH]1Sugarmoiety:
[N-]=[N+]=NCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.56 |
| AlogP: | -0.77 | Num_rotatable_bonds: | 3 |
| MolWt: | 348.11 | Num_heavy_atoms: | 20 |
| TPSA: | 153.31 | NumAromaticRings: | 1 |
Unique Aglycone
AD04715
Formula: C4H3O2N2Br
Smiles:
O=c1[nH]cc(Br)c(=O)[nH]1| HBA: | 4 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | -0.17 | Num_rotatable_bonds: | 0 |
| MolWt: | 190.98 | Num_heavy_atoms: | 9 |
| TPSA: | 65.72 | NumAromaticRings: | 1 |
