Glycoside
GD144147
Name:
XylostosidineFormula:
C18H25O8NSSmiles:
C=CC1C(OC2OC(CO)C(O)C(O)C2O)OC=C2C(=O)N3CCSC3CC21Aglycone:
C=CC1C(O)OC=C2C(=O)N3CCSC3CC21Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.72 |
| AlogP: | -1.23 | Num_rotatable_bonds: | 4 |
| MolWt: | 415.46 | Num_heavy_atoms: | 28 |
| TPSA: | 128.92 | NumAromaticRings: | 0 |
Unique Aglycone
AD57943
Formula: C12H15O3NS
Smiles:
C=CC1C(O)OC=C2C(=O)N3CCSC3CC21| HBA: | 4 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.58 |
| AlogP: | 0.94 | Num_rotatable_bonds: | 1 |
| MolWt: | 253.32 | Num_heavy_atoms: | 17 |
| TPSA: | 49.77 | NumAromaticRings: | 0 |
