(Q27225481)

(13S,14S)-epoxymaresin (English)

12 October 2016

chemical formula

C₂₂H₃₀O₃

1 reference

(13S,14S)-epoxymaresin (English)

12 October 2016

canonical SMILES

CCC=CCC=CCC1C(O1)C=CC=CC=CCC=CCCC(=O)O

1 reference

(13S,14S)-epoxymaresin (English)

12 October 2016

isomeric SMILES

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

1 reference

https://reactome.org/PathwayBrowser/#/R-HSA-1430728&DTAB=MT

(13S,14S)-epoxymaresin (English)

12 October 2016

1 reference

Identifiers

InChI

InChI=1S/C22H30O3/c1-2-3-4-5-11-14-17-20-21(25-20)18-15-12-9-7-6-8-10-13-16-19-22(23)24/h3-4,6-7,9-15,18,20-21H,2,5,8,16-17,19H2,1H3,(H,23,24)/b4-3-,7-6-,12-9+,13-10-,14-11-,18-15+/t20-,21-/m0/s1

1 reference

(13S,14S)-epoxymaresin (English)

FFAHMRSFNLJTHE-WGHUZSCTSA-N

12 October 2016

InChIKey

2 references

(13S,14S)-epoxymaresin (English)

12 October 2016

stated in

ChEBI release 2020-09-01

2 references

(13S,14S)-epoxymaresin (English)

matched by identifier from

12 October 2016

InChIKey

FFAHMRSFNLJTHE-WGHUZSCTSA-N

ChEBI ID

132228

mapping relation type

2 references

(13S,14S)-epoxy-(4Z,7Z,9E,11E,16Z,19Z)-docosahexaenoic acid (English)

matched by identifier from

12 October 2016

International Chemical Identifier

InChI

InChI=1S/C22H30O3/c1-2-3-4-5-11-14-17-20-21(25-20)18-15-12-9-7-6-8-10-13-16-19-22(23)24/h3-4,6-7,9-15,18,20-21H,2,5,8,16-17,19H2,1H3,(H,23,24)/b4-3-,7-6-,12-9+,13-10-,14-11-,18-15+/t20-,21-/m0/s1

SureChEMBL ID

SCHEMBL16681462

2 references

based on heuristic

inferred from InChIKey

matched by identifier from

InChIKey

FFAHMRSFNLJTHE-WGHUZSCTSA-N

1 reference

1 reference

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