Glycoside
GD011074
Name:
Mohangic Acid EFormula:
C32H47O11NSmiles:
C[C@@H](C[C@@H](C)[C@@H](O)[C@H](C)C=CC=CC=C[C@H](O)CC(=O)O)[C@H](O)CC(=O)c1ccc(N[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)cc1Aglycone:
CC(C=CC=CC=CC(O)CC(=O)O)C(O)C(C)CC(C)C(O)CC(=O)c1ccc(N)cc1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 2 |
| HBD: | 9 | FractionCSP3: | 0.56 |
| AlogP: | 1.0 | Num_rotatable_bonds: | 17 |
| MolWt: | 621.72 | Num_heavy_atoms: | 44 |
| TPSA: | 217.24 | NumAromaticRings: | 1 |
Unique Aglycone
AD08488
Formula: C26H37O6N
Smiles:
CC(C=CC=CC=CC(O)CC(=O)O)C(O)C(C)CC(C)C(O)CC(=O)c1ccc(N)cc1| HBA: | 7 | RingCount: | 1 |
| HBD: | 6 | FractionCSP3: | 0.46 |
| AlogP: | 3.37 | Num_rotatable_bonds: | 14 |
| MolWt: | 459.58 | Num_heavy_atoms: | 33 |
| TPSA: | 141.08 | NumAromaticRings: | 1 |
