Glycoside
GD081909
Name:
NoneFormula:
C19H26O8N2Smiles:
O=C(C(=O)N1C[C@@H]2COC[C@]2(COCc2ccncc2)C1)[C@H](O)[C@@H](O)[C@H](O)COAglycone:
c1cc(COCC23CNCC2COC3)ccn1Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.63 |
| AlogP: | -2.28 | Num_rotatable_bonds: | 9 |
| MolWt: | 410.42 | Num_heavy_atoms: | 29 |
| TPSA: | 149.65 | NumAromaticRings: | 1 |
Unique Aglycone
AD36795
Formula: C13H18O2N2
Smiles:
c1cc(COCC23CNCC2COC3)ccn1| HBA: | 4 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.62 |
| AlogP: | 0.83 | Num_rotatable_bonds: | 4 |
| MolWt: | 234.3 | Num_heavy_atoms: | 17 |
| TPSA: | 43.38 | NumAromaticRings: | 1 |
