Glycoside
GD067774
Name:
NoneFormula:
C16H23O6N3Smiles:
COC(=O)/N=c1\[nH]c2cc(C)c(C)cc2n1C[C@@H](O)[C@@H](O)[C@H](O)COAglycone:
COC(=O)N=c1[nH]c2cc(C)c(C)cc2n1CSugarmoiety:
OCC(O)C(O)C(O)OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.5 |
| AlogP: | -0.67 | Num_rotatable_bonds: | 5 |
| MolWt: | 353.38 | Num_heavy_atoms: | 25 |
| TPSA: | 140.3 | NumAromaticRings: | 2 |
Unique Aglycone
AD32231
Formula: C12H15O2N3
Smiles:
COC(=O)N=c1[nH]c2cc(C)c(C)cc2n1C| HBA: | 5 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.33 |
| AlogP: | 1.79 | Num_rotatable_bonds: | 0 |
| MolWt: | 233.27 | Num_heavy_atoms: | 17 |
| TPSA: | 59.38 | NumAromaticRings: | 2 |
