Glycoside
GD098625
Name:
NoneFormula:
C16H23O8N2BrSmiles:
COc1nc(OC)c(C(=O)NCCO[C@@H]2O[C@@H](C)[C@@H](O)[C@@H](O)[C@@H]2O)cc1BrAglycone:
COc1nc(OC)c(C(=O)NCCO)cc1BrSugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.62 |
| AlogP: | -0.56 | Num_rotatable_bonds: | 7 |
| MolWt: | 451.27 | Num_heavy_atoms: | 27 |
| TPSA: | 139.6 | NumAromaticRings: | 1 |
Unique Aglycone
AD41947
Formula: C10H13O4N2Br
Smiles:
COc1nc(OC)c(C(=O)NCCO)cc1Br| HBA: | 6 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.4 |
| AlogP: | 0.58 | Num_rotatable_bonds: | 5 |
| MolWt: | 305.13 | Num_heavy_atoms: | 17 |
| TPSA: | 80.68 | NumAromaticRings: | 1 |
