Glycoside
GD069418
Name:
NoneFormula:
C13H22O6NBrSmiles:
C[C@@H]1O[C@@H](OCCNC(=O)C2(Br)CCC2)[C@@H](O)[C@H](O)[C@@H]1OAglycone:
O=C(NCCO)C1(Br)CCC1Sugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.92 |
| AlogP: | -0.74 | Num_rotatable_bonds: | 5 |
| MolWt: | 368.22 | Num_heavy_atoms: | 21 |
| TPSA: | 108.25 | NumAromaticRings: | 0 |
Unique Aglycone
AD32943
Formula: C7H12O2NBr
Smiles:
O=C(NCCO)C1(Br)CCC1| HBA: | 3 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.86 |
| AlogP: | 0.41 | Num_rotatable_bonds: | 3 |
| MolWt: | 222.08 | Num_heavy_atoms: | 11 |
| TPSA: | 49.33 | NumAromaticRings: | 0 |
