Glycoside
GD069067
Name:
NoneFormula:
C14H23O6N3SSmiles:
CCCc1nnsc1C(=O)NCCO[C@@H]1O[C@@H](C)[C@@H](O)[C@@H](O)[C@@H]1OAglycone:
CCCc1nnsc1C(=O)NCCOSugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.79 |
| AlogP: | -0.94 | Num_rotatable_bonds: | 7 |
| MolWt: | 361.42 | Num_heavy_atoms: | 24 |
| TPSA: | 134.03 | NumAromaticRings: | 1 |
Unique Aglycone
AD32733
Formula: C8H13O2N3S
Smiles:
CCCc1nnsc1C(=O)NCCO| HBA: | 5 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.62 |
| AlogP: | 0.21 | Num_rotatable_bonds: | 5 |
| MolWt: | 215.28 | Num_heavy_atoms: | 14 |
| TPSA: | 75.11 | NumAromaticRings: | 1 |
