Glycoside
GD091176
Name:
NoneFormula:
C14H20O6N3SBrSmiles:
CSc1ncc(Br)c(C(=O)NCCO[C@@H]2O[C@@H](C)[C@@H](O)[C@@H](O)[C@@H]2O)n1Aglycone:
CSc1ncc(Br)c(C(=O)NCCO)n1Sugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.64 |
| AlogP: | -0.47 | Num_rotatable_bonds: | 6 |
| MolWt: | 438.3 | Num_heavy_atoms: | 25 |
| TPSA: | 134.03 | NumAromaticRings: | 1 |
Unique Aglycone
AD39744
Formula: C8H10O2N3SBr
Smiles:
CSc1ncc(Br)c(C(=O)NCCO)n1| HBA: | 5 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.38 |
| AlogP: | 0.68 | Num_rotatable_bonds: | 4 |
| MolWt: | 292.16 | Num_heavy_atoms: | 15 |
| TPSA: | 75.11 | NumAromaticRings: | 1 |
