Glycoside
GD099391
Name:
NoneFormula:
C16H19O6N2ISmiles:
C[C@@H]1O[C@@H](OCCNC(=O)c2cc(C#N)ccc2I)[C@@H](O)[C@H](O)[C@@H]1OAglycone:
N#Cc1ccc(I)c(C(=O)NCCO)c1Sugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.5 |
| AlogP: | -0.26 | Num_rotatable_bonds: | 5 |
| MolWt: | 462.24 | Num_heavy_atoms: | 25 |
| TPSA: | 132.04 | NumAromaticRings: | 1 |
Unique Aglycone
AD42267
Formula: C10H9O2N2I
Smiles:
N#Cc1ccc(I)c(C(=O)NCCO)c1| HBA: | 4 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.2 |
| AlogP: | 0.88 | Num_rotatable_bonds: | 3 |
| MolWt: | 316.1 | Num_heavy_atoms: | 15 |
| TPSA: | 73.12 | NumAromaticRings: | 1 |
