Glycoside
GD156879
Name:
NoneFormula:
C27H36O13NSmiles:
C=CC1C(OC2OC(CO)C(O)C(O)C2O)OC=C(C(=O)OC)C1C=CC1=CC(C(=O)O)=C[NH+](CCCC(=O)O)C1Aglycone:
C=CC1C(O)OC=C(C(=O)OC)C1C=CC1=CC(C(=O)O)=C[NH+](CCCC(=O)O)C1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 14 | RingCount: | 3 |
| HBD: | 7 | FractionCSP3: | 0.52 |
| AlogP: | -2.15 | Num_rotatable_bonds: | 12 |
| MolWt: | 582.58 | Num_heavy_atoms: | 41 |
| TPSA: | 213.95 | NumAromaticRings: | 0 |
Unique Aglycone
AD62075
Formula: C21H26O8N
Smiles:
C=CC1C(O)OC=C(C(=O)OC)C1C=CC1=CC(C(=O)O)=C[NH+](CCCC(=O)O)C1| HBA: | 9 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.38 |
| AlogP: | 0.02 | Num_rotatable_bonds: | 9 |
| MolWt: | 420.44 | Num_heavy_atoms: | 30 |
| TPSA: | 134.8 | NumAromaticRings: | 0 |
