Glycoside
GD053781
Name:
NoneFormula:
C14H23O5N4Smiles:
OC[C@H]1O[C@@H](O)[C@H](Nc2cc[nH+]c(N3CCCC3)n2)[C@@H](O)[C@@H]1OAglycone:
Nc1cc[nH+]c(N2CCCC2)n1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.71 |
| AlogP: | -2.29 | Num_rotatable_bonds: | 4 |
| MolWt: | 327.36 | Num_heavy_atoms: | 23 |
| TPSA: | 132.45 | NumAromaticRings: | 1 |
Unique Aglycone
AD27414
Formula: C8H13N4
Smiles:
Nc1cc[nH+]c(N2CCCC2)n1| HBA: | 4 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.5 |
| AlogP: | 0.08 | Num_rotatable_bonds: | 1 |
| MolWt: | 165.22 | Num_heavy_atoms: | 12 |
| TPSA: | 56.29 | NumAromaticRings: | 1 |
