(Q27146473)

CHEBI:76955 (English)

8 October 2016

2 references

inferred from InChIKey

based on heuristic

inferred from InChI

chemical formula

C₂₀H₃₀O₃

1 reference

CHEBI:76955 (English)

8 October 2016

canonical SMILES

CCC1C(O1)CC=CCC=CCC=CCC=CCCCC(=O)O

1 reference

CHEBI:76955 (English)

8 October 2016

isomeric SMILES

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

1 reference

CHEBI:76955 (English)

InChI=1S/C20H30O3/c1-2-18-19(23-18)16-14-12-10-8-6-4-3-5-7-9-11-13-15-17-20(21)22/h3,5-6,8-9,11-12,14,18-19H,2,4,7,10,13,15-17H2,1H3,(H,21,22)/b5-3-,8-6-,11-9-,14-12-/t18-,19+/m1/s1

8 October 2016

Identifiers

InChI

1 reference

CHEBI:76955 (English)

GPQVVJQEBXAKBJ-YQLHGUCYSA-N

8 October 2016

InChIKey

2 references

CHEBI:76955 (English)

CAS (formerly Chemical Abstracts Service)

8 October 2016

stated in

ChEBI release 2020-09-01

CAS Registry Number

131339-23-6

1 reference

stated in

25 January 2022

1 reference

(5Z,8Z,11Z,14Z)-16-[(2S,3R)-3-Ethyl-2-oxiranyl]-5,8,11,14-hexadecatetraenoic acid (English)

8 October 2016

2 references

CHEBI:76955 (English)

matched by identifier from

8 October 2016

InChIKey

GPQVVJQEBXAKBJ-YQLHGUCYSA-N

Reaxys registry number

21591682

1 reference

17(S),18(R)-EETeTr (English)

8 October 2016

ChEBI ID

76955

mapping relation type

2 references

17(S),18(R)-EETeTr (English)

matched by identifier from

8 October 2016

International Chemical Identifier

InChI

InChI=1S/C20H30O3/c1-2-18-19(23-18)16-14-12-10-8-6-4-3-5-7-9-11-13-15-17-20(21)22/h3,5-6,8-9,11-12,14,18-19H,2,4,7,10,13,15-17H2,1H3,(H,21,22)/b5-3-,8-6-,11-9-,14-12-/t18-,19+/m1/s1

1 reference