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[6-butoxy-3,4,5-tris(oxidanyl)oxan-2-yl]methyl docosanoate

[6-butoxy-3,4,5-tris(oxidanyl)oxan-2-yl]methyl docosanoate

Systemtic Name:[6-butoxy-3,4,5-tris(oxidanyl)oxan-2-yl]methyl docosanoate
Openeye Name:(6-butoxy-3,4,5-trihydroxy-tetrahydropyran-2-yl)methyl docosanoate
CAS Name:docosanoic acid (6-butoxy-3,4,5-trihydroxy-2-oxanyl)methyl ester
IUPAC Name:(6-butoxy-3,4,5-trihydroxyoxan-2-yl)methyl docosanoate
Traditional Name:behenic acid (6-butoxy-3,4,5-trihydroxy-tetrahydropyran-2-yl)methyl ester
Formula: C32H62O7
MolecularWeight: 558.83048
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCCCCC(=O)OCC1C(C(C(C(O1)OCCCC)O)O)O


Isomeric SMILES

CCCCCCCCCCCCCCCCCCCCCC(=O)OCC1C(C(C(C(O1)OCCCC)O)O)O


InChI

InChI=1S/C32H62O7/c1-3-5-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-28(33)38-26-27-29(34)30(35)31(36)32(39-27)37-25-6-4-2/h27,29-32,34-36H,3-26H2,1-2H3


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