(Q105177160)

English

NCFDJDBFEOAGAU-SSPSLKKNSA-N

chemical compound

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No label defined

No description defined

Statements

type of chemical entity

0 references

[1,5,5-Trimethyl-6-[3,7,12,16-tetramethyl-18-(2,2,6-trimethyl-4-tetradecanoyloxy-7-oxabicyclo[4.1.0]heptan-1-yl)octadeca-1,3,5,7,9,11,13,15,17-nonaenyl]-7-oxabicyclo[4.1.0]heptan-3-yl] tetradecanoate

1 reference

based on heuristic

inferred from SMILES

1,020.814591176 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₆₈H₁₀₈O₆

0 references

canonical SMILES

O=C(OC1CC2(OC2(C=CC(=CC=CC(=CC=CC=C(C=CC=C(C=CC34OC4(C)CC(OC(=O)CCCCCCCCCCCCC)CC3(C)C)C)C)C)C)C(C)(C)C1)C)CCCCCCCCCCCCC

0 references

isomeric SMILES

CCCCCCCCCCCCCC(=O)O[C@H]1CC(C)(C)[C@]2(/C=C/C(C)=C/C=C/C(C)=C/C=C/C=C(C)/C=C/C=C(C)/C=C/[C@@]34O[C@]3(C)C[C@@H](OC(=O)CCCCCCCCCCCCC)CC4(C)C)O[C@]2(C)C1

0 references

1 reference

Carotenoids and carotenoid esters in potatoes (Solanum tuberosum L.): new insights into an ancient vegetable

Identifiers

InChI=1S/C68H108O6/c1-13-15-17-19-21-23-25-27-29-31-33-45-61(69)71-59-51-63(7,8)67(65(11,53-59)73-67)49-47-57(5)43-37-41-55(3)39-35-36-40-56(4)42-38-44-58(6)48-50-68-64(9,10)52-60(54-66(68,12)74-68)72-62(70)46-34-32-30-28-26-24-22-20-18-16-14-2/h35-44,47-50,59-60H,13-34,45-46,51-54H2,1-12H3/b36-35+,41-37+,42-38+,49-47+,50-48+,55-39+,56-40+,57-43+,58-44+/t59-,60-,65+,66+,67-,68-/m0/s1

0 references

NCFDJDBFEOAGAU-SSPSLKKNSA-N

0 references

2 references

15 September 2022

matched by identifier from

NCFDJDBFEOAGAU-SSPSLKKNSA-N

1 reference

http://www.lipidmaps.org/rest/compound/lm_id/LM/all/download

15 January 2022

NCFDJDBFEOAGAU-SSPSLKKNSA-N

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