Glycoside
GD051846
Name:
NoneFormula:
C14H21O5N3Smiles:
OC[C@H]1O[C@@H](n2cc(C3=CCCCC3)nn2)[C@H](O)[C@@H](O)[C@H]1OAglycone:
C1=C(C2=C[N]N=N2)CCCC1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.71 |
| AlogP: | -0.79 | Num_rotatable_bonds: | 3 |
| MolWt: | 311.34 | Num_heavy_atoms: | 22 |
| TPSA: | 120.86 | NumAromaticRings: | 1 |
Unique Aglycone
AD27024
Formula: C8H10N3
Smiles:
C1=C(C2=C[N]N=N2)CCCC1| HBA: | 3 | RingCount: | 2 |
| HBD: | 0 | FractionCSP3: | 0.5 |
| AlogP: | 2.31 | Num_rotatable_bonds: | 1 |
| MolWt: | 148.19 | Num_heavy_atoms: | 11 |
| TPSA: | 38.82 | NumAromaticRings: | 0 |
