methyl (13S)-13-(oxan-2-yloxy)-10-oxidanyl-octadec-11-ynoate

Systemtic Name: methyl (13S)-13-(oxan-2-yloxy)-10-oxidanyl-octadec-11-ynoate Openeye Name: methyl (13S)-10-hydroxy-13-tetrahydropyran-2-yloxy-octadec-11-ynoate CAS Name: (13S)-10-hydroxy-13-(2-oxanyloxy)-11-octadecynoic acid methyl ester IUPAC Name: methyl (13S)-10-hydroxy-13-(oxan-2-yloxy)octadec-11-ynoate Traditional Name: (13S)-10-hydroxy-13-tetrahydropyran-2-yloxy-octadec-11-ynoic acid methyl ester Formula: C24H42O5 MolecularWeight: 410.58728

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C#CC(CCCCCCCCC(=O)OC)O)OC1CCCCO1

Isomeric SMILES

CCCCC[C@@H](C#CC(CCCCCCCCC(=O)OC)O)OC1CCCCO1

InChI

InChI=1S/C24H42O5/c1-3-4-9-15-22(29-24-17-12-13-20-28-24)19-18-21(25)14-10-7-5-6-8-11-16-23(26)27-2/h21-22,24-25H,3-17,20H2,1-2H3/t21?,22-,24?/m0/s1