Glycoside
GD088215
Name:
NoneFormula:
C15H19O8N2BrSmiles:
COC(=O)[C@H](Cc1ccc(Br)cn1)NC(=O)C(=O)[C@H](O)[C@@H](O)[C@@H](O)COAglycone:
COC(=O)C(N)Cc1ccc(Br)cn1Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 10 | RingCount: | 1 |
| HBD: | 5 | FractionCSP3: | 0.47 |
| AlogP: | -2.31 | Num_rotatable_bonds: | 9 |
| MolWt: | 435.23 | Num_heavy_atoms: | 26 |
| TPSA: | 166.28 | NumAromaticRings: | 1 |
Unique Aglycone
AD38617
Formula: C9H11O2N2Br
Smiles:
COC(=O)C(N)Cc1ccc(Br)cn1| HBA: | 4 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.33 |
| AlogP: | 0.89 | Num_rotatable_bonds: | 3 |
| MolWt: | 259.1 | Num_heavy_atoms: | 14 |
| TPSA: | 65.21 | NumAromaticRings: | 1 |
