(Q27145217)

CHEBI:75327 (English)

8 October 2016

chemical formula

C₂₀H₃₁O₄⁻

1 reference

based on heuristic

inferred from SMILES

canonical SMILES

CCCCCC=CCC=CC(C1C(O1)CC=CCCCC(=O)[O-])O

1 reference

CHEBI:75327 (English)

8 October 2016

isomeric SMILES

CCCCC/C=C\C/C=C\[C@@H]([C@@H]1[C@@H](O1)C/C=C\CCCC(=O)[O-])O

1 reference

CHEBI:75327 (English)

InChI=1S/C20H32O4/c1-2-3-4-5-6-7-8-11-14-17(21)20-18(24-20)15-12-9-10-13-16-19(22)23/h6-7,9,11-12,14,17-18,20-21H,2-5,8,10,13,15-16H2,1H3,(H,22,23)/p-1/b7-6-,12-9-,14-11-/t17-,18-,20+/m0/s1

8 October 2016

Identifiers

InChI

1 reference

CHEBI:75327 (English)

WWOUHSVXNYZFBQ-MCRRFWBCSA-M

8 October 2016

InChIKey

2 references

CHEBI:75327 (English)

8 October 2016

stated in

ChEBI release 2020-09-01

1 reference

(5Z)-7-{(2S,3R)-3-[(1S,2Z,5Z)-1-Hydroxy-2,5-undecadien-1-yl]-2-oxiranyl}-5-heptenoate (English)

8 October 2016

2 references

CHEBI:75327 (English)

matched by identifier from

8 October 2016

InChIKey

WWOUHSVXNYZFBQ-MCRRFWBCSA-M

ChEBI ID

75327

mapping relation type

2 references

(8S,9S)-epoxy-(10R)-hydroxyicosa-(5Z,11Z,14Z)-trienoate (English)

matched by identifier from

8 October 2016

International Chemical Identifier

InChI

InChI=1S/C20H32O4/c1-2-3-4-5-6-7-8-11-14-17(21)20-18(24-20)15-12-9-10-13-16-19(22)23/h6-7,9,11-12,14,17-18,20-21H,2-5,8,10,13,15-16H2,1H3,(H,22,23)/p-1/b7-6-,12-9-,14-11-/t17-,18-,20+/m0/s1

1 reference

2 references

https://www.swisslipids.org/#/downloads