Glycoside
GD063394
Name:
NoneFormula:
C14H24O6N3SSmiles:
C[C@@H]1O[C@@H](OCCNC(=O)c2cnc([C@@H](C)[NH3+])s2)[C@@H](O)[C@H](O)[C@@H]1OAglycone:
CC([NH3+])c1ncc(C(=O)NCCO)s1Sugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 2 |
| HBD: | 7 | FractionCSP3: | 0.71 |
| AlogP: | -1.98 | Num_rotatable_bonds: | 6 |
| MolWt: | 362.43 | Num_heavy_atoms: | 24 |
| TPSA: | 148.78 | NumAromaticRings: | 1 |
Unique Aglycone
AD30541
Formula: C8H14O2N3S
Smiles:
CC([NH3+])c1ncc(C(=O)NCCO)s1| HBA: | 5 | RingCount: | 1 |
| HBD: | 5 | FractionCSP3: | 0.5 |
| AlogP: | -0.83 | Num_rotatable_bonds: | 4 |
| MolWt: | 216.29 | Num_heavy_atoms: | 14 |
| TPSA: | 89.86 | NumAromaticRings: | 1 |
