Glycoside
GD025038
Name:
ALTERNAROSIDE BFormula:
C42H77O9NSmiles:
CCCCCCCCCCCCCCC=C[C@H](O)C(=O)N[C@H](CO[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O)[C@H](O)C=CCCC=C(C)CCCCCCCCAglycone:
CCCCCCCCCCCCCCC=CC(O)C(=O)NC(CO)C(O)C=CCCC=C(C)CCCCCCCCSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 1 |
| HBD: | 7 | FractionCSP3: | 0.83 |
| AlogP: | 6.69 | Num_rotatable_bonds: | 32 |
| MolWt: | 740.08 | Num_heavy_atoms: | 52 |
| TPSA: | 168.94 | NumAromaticRings: | 0 |
Unique Aglycone
AD16647
Formula: C36H67O4N
Smiles:
CCCCCCCCCCCCCCC=CC(O)C(=O)NC(CO)C(O)C=CCCC=C(C)CCCCCCCC| HBA: | 5 | RingCount: | 0 |
| HBD: | 4 | FractionCSP3: | 0.81 |
| AlogP: | 8.87 | Num_rotatable_bonds: | 29 |
| MolWt: | 577.94 | Num_heavy_atoms: | 41 |
| TPSA: | 89.79 | NumAromaticRings: | 0 |
