CHEBI:140208 - aspirin-triggered protectin D1(1−)

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name aspirin-triggered protectin D1(1−)
ChEBI ID CHEBI:140208
ChEBI ASCII Name aspirin-triggered protectin D1(1-)
Definition A dihydroxydocosahexaenoate that is the conjugate base of aspirin-triggered 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.
Supplier Information No supplier information found for this compound.
Download Molfile XML SDF
Formula C22H31O4
Net Charge -1
Average Mass 359.480
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-/m1/s1
InChIKey CRDZYJSQHCXHEG-HBMALMRFSA-M
SMILES [O-]C(CC/C=C\C/C=C\C[C@H](\C=C\C=C\C=C/[C@@H](C/C=C\CC)O)O)=O
ChEBI Ontology
Outgoing aspirin-triggered protectin D1(1−) (CHEBI:140208) is a dihydroxydocosahexaenoate (CHEBI:136528)
aspirin-triggered protectin D1(1−) (CHEBI:140208) is conjugate base of aspirin-triggered protectin D1 (CHEBI:140202)
Incoming aspirin-triggered protectin D1 (CHEBI:140202) is conjugate acid of aspirin-triggered protectin D1(1−) (CHEBI:140208)
IUPAC Name
(4Z,7Z,10R,11E,13E,15Z,17R,19Z)-10,17-dihydroxydocosa-4,7,11,13,15,19-hexaenoate
Synonyms Sources
(4Z,7Z,10R,11E,13E,15Z,17R,19Z)-10,17-dihydroxydocosahexaenoate ChEBI
10(R),17(R)-dihydroxydocosa-4Z,7Z,11E,13E,15Z,19Z-hexaenoate ChEBI
aspirin-triggered neuroprotectin D1(1−) ChEBI
AT-(NPD1/PD1)(1−) ChEBI
AT-NPD1(1−) ChEBI
AT-PD1(1−) ChEBI
Last Modified
22 February 2018