Glycoside
GD088111
Name:
NoneFormula:
C18H23O9N3Smiles:
CC(C)(C)OC(=O)/N=c1/c2cc(N)ccc2on1C(=O)C(=O)[C@H](O)[C@@H](O)[C@@H](O)COAglycone:
CC(C)(C)OC(=O)N=C1[N]Oc2ccc(N)cc21Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 12 | RingCount: | 2 |
| HBD: | 6 | FractionCSP3: | 0.44 |
| AlogP: | -1.06 | Num_rotatable_bonds: | 5 |
| MolWt: | 425.39 | Num_heavy_atoms: | 30 |
| TPSA: | 197.81 | NumAromaticRings: | 2 |
Unique Aglycone
AD38589
Formula: C12H14O3N3
Smiles:
CC(C)(C)OC(=O)N=C1[N]Oc2ccc(N)cc21| HBA: | 6 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.33 |
| AlogP: | 1.86 | Num_rotatable_bonds: | 0 |
| MolWt: | 248.26 | Num_heavy_atoms: | 18 |
| TPSA: | 88.01 | NumAromaticRings: | 1 |
