[(2S)-2-[(7Z,10Z)-hexadeca-7,10-dienoyl]oxy-3-[(2R,3R,4S,5R,6R)-6-(hydroxymethyl)-3,4,5-tris(oxidanyl)oxan-2-yl]oxy-propyl] (7Z,10Z)-hexadeca-7,10-dienoate

Systemtic Name: [(2S)-2-[(7Z,10Z)-hexadeca-7,10-dienoyl]oxy-3-[(2R,3R,4S,5R,6R)-6-(hydroxymethyl)-3,4,5-tris(oxidanyl)oxan-2-yl]oxy-propyl] (7Z,10Z)-hexadeca-7,10-dienoate Openeye Name: [(2S)-2-[(7Z,10Z)-hexadeca-7,10-dienoyl]oxy-3-[(2R,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxy-propyl] (7Z,10Z)-hexadeca-7,10-dienoate CAS Name: (7Z,10Z)-hexadeca-7,10-dienoic acid [(2S)-2-[(7Z,10Z)-1-oxohexadeca-7,10-dienoxy]-3-[[(2R,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)-2-oxanyl]oxy]propyl] ester IUPAC Name: [(2S)-2-[(7Z,10Z)-hexadeca-7,10-dienoyl]oxy-3-[(2R,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxypropyl] (7Z,10Z)-hexadeca-7,10-dienoate Traditional Name: (7Z,10Z)-hexadeca-7,10-dienoic acid [(2S)-2-[(7Z,10Z)-hexadeca-7,10-dienoyl]oxy-3-[(2R,3R,4S,5R,6R)-3,4,5-trihydroxy-6-methylol-tetrahydropyran-2-yl]oxy-propyl] ester Formula: C41H70O10 MolecularWeight: 722.9885

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC=CCC=CCCCCCC(=O)OCC(COC1C(C(C(C(O1)CO)O)O)O)OC(=O)CCCCCC=CCC=CCCCCC

Isomeric SMILES

CCCCC/C=C\C/C=C\CCCCCC(=O)OC[C@H](CO[C@H]1[C@@H]([C@H]([C@H]([C@H](O1)CO)O)O)O)OC(=O)CCCCC/C=C\C/C=C\CCCCC

InChI

InChI=1S/C41H70O10/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-36(43)48-32-34(33-49-41-40(47)39(46)38(45)35(31-42)51-41)50-37(44)30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h11-14,17-20,34-35,38-42,45-47H,3-10,15-16,21-33H2,1-2H3/b13-11-,14-12-,19-17-,20-18-/t34-,35-,38+,39+,40-,41-/m1/s1