Glycoside
GD116267
Name:
4-(1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl)-N-[2,4,5-trihydroxy-6-(hydroxymethyl)oxan-3-yl]butanamideFormula:
C18H22O8N2Smiles:
O=C1c2ccccc2C(=O)N1CCCC(O)=NC1C(O)OC(CO)C(O)C1OAglycone:
N=C(O)CCCN1C(=O)c2ccccc2C1=OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.5 |
| AlogP: | -1.18 | Num_rotatable_bonds: | 6 |
| MolWt: | 394.38 | Num_heavy_atoms: | 28 |
| TPSA: | 160.12 | NumAromaticRings: | 1 |
Unique Aglycone
AD44992
Formula: C12H12O3N2
Smiles:
N=C(O)CCCN1C(=O)c2ccccc2C1=O| HBA: | 5 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.25 |
| AlogP: | 1.6 | Num_rotatable_bonds: | 4 |
| MolWt: | 232.24 | Num_heavy_atoms: | 17 |
| TPSA: | 81.46 | NumAromaticRings: | 1 |
