(2-oxidanyl-3-phosphonooxy-propyl) 8-[3-[(Z)-4-(3-ethyloxiran-2-yl)but-2-enyl]oxiran-2-yl]octanoate

Systemtic Name: (2-oxidanyl-3-phosphonooxy-propyl) 8-[3-[(Z)-4-(3-ethyloxiran-2-yl)but-2-enyl]oxiran-2-yl]octanoate Openeye Name: (2-hydroxy-3-phosphonooxy-propyl) 8-[3-[(Z)-4-(3-ethyloxiran-2-yl)but-2-enyl]oxiran-2-yl]octanoate CAS Name: 8-[3-[(Z)-4-(3-ethyl-2-oxiranyl)but-2-enyl]-2-oxiranyl]octanoic acid (2-hydroxy-3-phosphonooxypropyl) ester IUPAC Name: (2-hydroxy-3-phosphonooxypropyl) 8-[3-[(Z)-4-(3-ethyloxiran-2-yl)but-2-enyl]oxiran-2-yl]octanoate Traditional Name: 8-[3-[(Z)-4-(3-ethyloxiran-2-yl)but-2-enyl]oxiran-2-yl]caprylic acid (2-hydroxy-3-phosphonooxy-propyl) ester Formula: C21H37O9P MolecularWeight: 464.486841

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Descriptors Computed from Structure

Canonical SMILES:

CCC1C(O1)CC=CCC2C(O2)CCCCCCCC(=O)OCC(COP(=O)(O)O)O

Isomeric SMILES

CCC1C(O1)C/C=C\CC2C(O2)CCCCCCCC(=O)OCC(COP(=O)(O)O)O

InChI

InChI=1S/C21H37O9P/c1-2-17-18(29-17)11-8-9-12-20-19(30-20)10-6-4-3-5-7-13-21(23)27-14-16(22)15-28-31(24,25)26/h8-9,16-20,22H,2-7,10-15H2,1H3,(H2,24,25,26)/b9-8-