Glycoside
GD018271
Name:
ALTERNAROSIDE AFormula:
C43H77O10NSmiles:
C=C(CCCCCCCCC)C(=O)CCC=C[C@H](O)[C@H](CO[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O)NC(=O)[C@H](O)C=CCCCCCCCCCCCCCCAglycone:
C=C(CCCCCCCCC)C(=O)CCC=CC(O)C(CO)NC(=O)C(O)C=CCCCCCCCCCCCCCCSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 1 |
| HBD: | 7 | FractionCSP3: | 0.81 |
| AlogP: | 6.26 | Num_rotatable_bonds: | 34 |
| MolWt: | 768.09 | Num_heavy_atoms: | 54 |
| TPSA: | 186.01 | NumAromaticRings: | 0 |
Unique Aglycone
AD12921
Formula: C37H67O5N
Smiles:
C=C(CCCCCCCCC)C(=O)CCC=CC(O)C(CO)NC(=O)C(O)C=CCCCCCCCCCCCCCC| HBA: | 6 | RingCount: | 0 |
| HBD: | 4 | FractionCSP3: | 0.78 |
| AlogP: | 8.44 | Num_rotatable_bonds: | 31 |
| MolWt: | 605.94 | Num_heavy_atoms: | 43 |
| TPSA: | 106.86 | NumAromaticRings: | 0 |
