CHEBI:195348 - protectin D1(1−)

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name protectin D1(1−)
ChEBI ID CHEBI:195348
ChEBI ASCII Name protectin D1(1-)
Definition A dihydroxydocosahexaenoate that is the conjugate base of protectin D1, obtained by deprotonation of the carboxy group; major species at pH 7.3.
Stars This entity has been manually annotated by the ChEBI Team.
Submitter laimo
Supplier Information ZINC000169309052
Download Molfile XML SDF
Formula C22H31O4
Net Charge -1
Average Mass 359.487
Monoisotopic Mass 359.22278
InChI InChI=1S/C22H32O4/c1-2-3-10-15-20(23)17-12-8-9-13-18-21(24)16-11-6-4-5-7-14-19-22(25)26/h3,5-13,17-18,20-21,23-24H,2,4,14-16,19H2,1H3,(H,25,26)/p-1/b7-5-,9-8+,10-3-,11-6-,17-12-,18-13+/t20-,21+/m0/s1
InChIKey CRDZYJSQHCXHEG-SFVBTVKNSA-M
SMILES CC\C=C/C[C@H](O)\C=C/C=C/C=C/[C@H](O)C\C=C/C\C=C/CCC([O-])=O
ChEBI Ontology
Outgoing protectin D1(1−) (CHEBI:195348) is a dihydroxydocosahexaenoate (CHEBI:136528)
protectin D1(1−) (CHEBI:195348) is conjugate base of protectin D1 (CHEBI:138655)
Incoming protectin D1 (CHEBI:138655) is conjugate acid of protectin D1(1−) (CHEBI:195348)
IUPAC Name
(4Z,7Z,10R,11E,13E,15Z,17S,19Z)-10,17-dihydroxydocosa-4,7,11,13,15,19-hexaenoate
Synonyms Sources
(10R,17S)-dihydroxy-(4Z,7Z,11E,13E,15Z,19Z)-docosahexaenoate UniProt
neuroprotectin D1 anion ChEBI
neuroprotectin D1(1−) SUBMITTER
protectin D1 anion ChEBI
Citation
Last Modified
12 July 2023