Glycoside
GD052391
Name:
NoneFormula:
C15H22O4N3Smiles:
C/[NH+]=c1\[nH]c2cc(C)c(C)cc2n1[C@H]1O[C@@H](CO)[C@@H](O)[C@@H]1OAglycone:
C[NH+]=c1[nH]c2cc(C)c(C)cc2[nH]1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.53 |
| AlogP: | -2.19 | Num_rotatable_bonds: | 2 |
| MolWt: | 308.36 | Num_heavy_atoms: | 22 |
| TPSA: | 104.61 | NumAromaticRings: | 2 |
Unique Aglycone
AD27145
Formula: C10H14N3
Smiles:
C[NH+]=c1[nH]c2cc(C)c(C)cc2[nH]1| HBA: | 3 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.3 |
| AlogP: | -0.28 | Num_rotatable_bonds: | 0 |
| MolWt: | 176.24 | Num_heavy_atoms: | 13 |
| TPSA: | 45.55 | NumAromaticRings: | 2 |
