2R-2-[(1R)-1-hydroxy-16-{2-[10-(2-octadecylcyclopropyl)decyl]cyclopropyl}hexadecyl]hexacosanoate (Q27159981)

CHEBI:87921 (English)

9 October 2016

chemical formula

C₇₆H₁₄₇O₃⁻

1 reference

based on heuristic

inferred from SMILES

canonical SMILES

CCCCCCCCCCCCCCCCCCCCCCCCC(C(CCCCCCCCCCCCCCCC1CC1CCCCCCCCCCC2CC2CCCCCCCCCCCCCCCCCC)O)C(=O)[O-]

1 reference

CHEBI:87921 (English)

9 October 2016

isomeric SMILES

CCCCCCCCCCCCCCCCCCCCCCCC[C@H]([C@@H](CCCCCCCCCCCCCCCC1CC1CCCCCCCCCCC2CC2CCCCCCCCCCCCCCCCCC)O)C(=O)[O-]

1 reference

CHEBI:87921 (English)

InChI=1S/C76H148O3/c1-3-5-7-9-11-13-15-17-19-21-22-23-24-25-26-28-32-36-40-48-54-60-66-74(76(78)79)75(77)67-61-55-49-41-37-33-29-31-35-39-45-51-57-63-71-69-73(71)65-59-53-47-43-42-46-52-58-64-72-68-70(72)62-56-50-44-38-34-30-27-20-18-16-14-12-10-8-6-4-2/h70-75,77H,3-69H2,1-2H3,(H,78,79)/p-1/t70?,71?,72?,73?,74-,75-/m1/s1

9 October 2016

Identifiers

InChI

1 reference

CHEBI:87921 (English)

BCYWCCTUDCPBSD-IEAGMYRTSA-M

9 October 2016

InChIKey

2 references

CHEBI:87921 (English)

9 October 2016

stated in

ChEBI release 2020-09-01

2 references

CHEBI:87921 (English)

matched by identifier from

9 October 2016

InChIKey

BCYWCCTUDCPBSD-IEAGMYRTSA-M

ChEBI ID

87921

mapping relation type

2 references

2R-2-[(1R)-1-hydroxy-16-{2-[10-(2-octadecylcyclopropyl)decyl]cyclopropyl}hexadecyl]hexacosanoate (English)