Glycoside
GD107087
Name:
NoneFormula:
C30H42O11N2Smiles:
CCOC(=O)[C@H](CCc1ccccc1)N[C@@H](C)C(=O)N1[C@H](C(=O)O[C@@H]2O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]2O)C[C@H]2CCCC[C@@H]21Aglycone:
CCOC(=O)C(CCc1ccccc1)NC(C)C(=O)N1C(C(=O)O)CC2CCCCC21Sugarmoiety:
O=C(O)C1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 13 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.67 |
| AlogP: | 0.12 | Num_rotatable_bonds: | 11 |
| MolWt: | 606.67 | Num_heavy_atoms: | 43 |
| TPSA: | 192.16 | NumAromaticRings: | 1 |
Unique Aglycone
AD44275
Formula: C24H34O5N2
Smiles:
CCOC(=O)C(CCc1ccccc1)NC(C)C(=O)N1C(C(=O)O)CC2CCCCC21| HBA: | 7 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.62 |
| AlogP: | 2.77 | Num_rotatable_bonds: | 9 |
| MolWt: | 430.55 | Num_heavy_atoms: | 31 |
| TPSA: | 95.94 | NumAromaticRings: | 1 |
