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[3,4,5-tris(oxidanyl)-1-oxidanylidene-pentan-2-yl] (E)-octadec-9-enoate

[3,4,5-tris(oxidanyl)-1-oxidanylidene-pentan-2-yl] (E)-octadec-9-enoate

Systemtic Name:[3,4,5-tris(oxidanyl)-1-oxidanylidene-pentan-2-yl] (E)-octadec-9-enoate
Openeye Name:(1-formyl-2,3,4-trihydroxy-butyl) (E)-octadec-9-enoate
CAS Name:(E)-9-octadecenoic acid (3,4,5-trihydroxy-1-oxopentan-2-yl) ester
IUPAC Name:(3,4,5-trihydroxy-1-oxopentan-2-yl) (E)-octadec-9-enoate
Traditional Name:(E)-octadec-9-enoic acid (1-formyl-2,3,4-trihydroxy-butyl) ester
Formula: C23H42O6
MolecularWeight: 414.57598
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC=CCCCCCCCC(=O)OC(C=O)C(C(CO)O)O


Isomeric SMILES

CCCCCCCC/C=C/CCCCCCCC(=O)OC(C=O)C(C(CO)O)O


InChI

InChI=1S/C23H42O6/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-22(27)29-21(19-25)23(28)20(26)18-24/h9-10,19-21,23-24,26,28H,2-8,11-18H2,1H3/b10-9+


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