Glycoside
GD061074
Name:
NoneFormula:
C15H25O5N3Smiles:
OC[C@H]1O[C@H](O)[C@H](n2cc(CC3CCCCC3)nn2)[C@@H](O)[C@@H]1OAglycone:
C1=C(CC2CCCCC2)N=N[N]1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.87 |
| AlogP: | -0.63 | Num_rotatable_bonds: | 4 |
| MolWt: | 327.38 | Num_heavy_atoms: | 23 |
| TPSA: | 120.86 | NumAromaticRings: | 1 |
Unique Aglycone
AD29995
Formula: C9H14N3
Smiles:
C1=C(CC2CCCCC2)N=N[N]1| HBA: | 3 | RingCount: | 2 |
| HBD: | 0 | FractionCSP3: | 0.78 |
| AlogP: | 2.78 | Num_rotatable_bonds: | 2 |
| MolWt: | 164.23 | Num_heavy_atoms: | 12 |
| TPSA: | 38.82 | NumAromaticRings: | 0 |
