methyl 2-[(3S,6R)-6-methoxy-6-[(E)-15-oxidanylidenehexadec-6-en-4-ynyl]-1,2-dioxan-3-yl]ethanoate

Systemtic Name: methyl 2-[(3S,6R)-6-methoxy-6-[(E)-15-oxidanylidenehexadec-6-en-4-ynyl]-1,2-dioxan-3-yl]ethanoate Openeye Name: methyl 2-[(3S,6R)-6-methoxy-6-[(E)-15-oxohexadec-6-en-4-ynyl]dioxan-3-yl]acetate CAS Name: 2-[(3S,6R)-6-methoxy-6-[(E)-15-oxohexadec-6-en-4-ynyl]-3-dioxanyl]acetic acid methyl ester IUPAC Name: methyl 2-[(3S,6R)-6-methoxy-6-[(E)-15-oxohexadec-6-en-4-ynyl]dioxan-3-yl]acetate Traditional Name: 2-[(3S,6R)-6-[(E)-15-ketohexadec-6-en-4-ynyl]-6-methoxy-dioxan-3-yl]acetic acid methyl ester Formula: C24H38O6 MolecularWeight: 422.55492

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CCCCCCCC=CC#CCCCC1(CCC(OO1)CC(=O)OC)OC

Isomeric SMILES

CC(=O)CCCCCCC/C=C/C#CCCC[C@@]1(CC[C@H](OO1)CC(=O)OC)OC

InChI

InChI=1S/C24H38O6/c1-21(25)16-14-12-10-8-6-4-5-7-9-11-13-15-18-24(28-3)19-17-22(29-30-24)20-23(26)27-2/h5,7,22H,4,6,8,10,12-20H2,1-3H3/b7-5+/t22-,24+/m0/s1