Molecule ID: 10038289

IUPAC Name: (3S,6R)-3-benzyl-4-methyl-6-propan-2-ylmorpholine-2,5-dione

Description: The molecule is a member of the class of morpholines that is morpholine-2,5-dione substituted by a benzyl, isopropyl and a methyl group at positions 3, 6 and 4 respectively. It is isolated from the culture broth of the fungus Beauveria bassiana and acts as a platelet aggregation inhibitor. It has a role as a metabolite, an antimicrobial agent and a platelet aggregation inhibitor. It is a member of morpholines and a diketone.

SMILES: CC(C)[C@H]1OC(=O)[C@H](Cc2ccccc2)N(C)C1=O

SELFIES: [C][C][Branch1][C][C][C@H1][O][C][=Branch1][C][=O][C@H1][Branch1][#Branch2][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][Branch1][C][C][C][Ring1][#C][=O]

InChI: InChI=1S/C15H19NO3/c1-10(2)13-14(17)16(3)12(15(18)19-13)9-11-7-5-4-6-8-11/h4-8,10,12-13H,9H2,1-3H3/t12-,13+/m0/s1

Molecular Properties:
- Polar Surface Area: 46.6 Ų
- LogP: 2.8