(Q105121674)

English

[(2S)-2-[(E)-hexadec-9-enoyl]oxy-3-[(2R,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxypropyl] (9Z,12Z)-octadeca-9,12-dienoate

chemical compound

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Statements

instance of

type of chemical entity

0 references

subclass of

[2-Hexadec-9-enoyloxy-3-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxypropyl] octadeca-9,12-dienoate

1 reference

based on heuristic

inferred from SMILES

mass

752.543848632 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₄₃H₇₆O₁₀

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canonical SMILES

O=C(OCC(OC(=O)CCCCCCCC=CCCCCCC)COC1OC(CO)C(O)C(O)C1O)CCCCCCCC=CCC=CCCCCC

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isomeric SMILES

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

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found in taxon

Leptolyngbya tenuis

1 reference

stated in

Studies on Glycolipids. III. Glyceroglycolipids from an Axenically Cultured Cyanobacterium, Phormidium tenue

Identifiers

InChI

InChI=1S/C43H76O10/c1-3-5-7-9-11-13-15-17-18-20-21-23-25-27-29-31-38(45)50-34-36(35-51-43-42(49)41(48)40(47)37(33-44)53-43)52-39(46)32-30-28-26-24-22-19-16-14-12-10-8-6-4-2/h11,13-14,16-18,36-37,40-44,47-49H,3-10,12,15,19-35H2,1-2H3/b13-11-,16-14+,18-17-/t36-,37-,40+,41+,42-,43-/m1/s1

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InChIKey

IWJCRGZJKBTJLY-FNDMRJAYSA-N

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2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

IWJCRGZJKBTJLY-FNDMRJAYSA-N

(Q105121674)

[(2S)-2-[(E)-hexadec-9-enoyl]oxy-3-[(2R,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxypropyl] (9Z,12Z)-octadeca-9,12-dienoate

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Identifiers

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