Glycoside
GD099189
Name:
N-methyl-2-{4-methyl-7-[(2-methylprop-2-en-1-yl)oxy]-2-oxo-2H-chromen-3-yl}-N-(2,3,4,5,6-pentahydroxyhexyl)acetamideFormula:
C23H31O9NSmiles:
C=C(C)COc1ccc2c(C)c(CC(=O)N(C)C[C@@H](O)[C@@H](O)[C@H](O)[C@@H](O)CO)c(=O)oc2c1Aglycone:
C=C(C)COc1ccc2c(C)c(CC(=O)N(C)C)c(=O)oc2c1Sugarmoiety:
OCC(O)C(O)C(O)C(O)OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.48 |
| AlogP: | -0.51 | Num_rotatable_bonds: | 11 |
| MolWt: | 465.5 | Num_heavy_atoms: | 33 |
| TPSA: | 160.9 | NumAromaticRings: | 2 |
Unique Aglycone
AD42203
Formula: C18H21O4N
Smiles:
C=C(C)COc1ccc2c(C)c(CC(=O)N(C)C)c(=O)oc2c1| HBA: | 5 | RingCount: | 2 |
| HBD: | 0 | FractionCSP3: | 0.33 |
| AlogP: | 2.69 | Num_rotatable_bonds: | 5 |
| MolWt: | 315.37 | Num_heavy_atoms: | 23 |
| TPSA: | 59.75 | NumAromaticRings: | 2 |
