CHEBI:175705 - 12-oxo-10,11-dihydro-20-COOH-LTB4

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ChEBI Name 12-oxo-10,11-dihydro-20-COOH-LTB4
ChEBI ID CHEBI:175705
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
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Formula C20H30O6
Net Charge 0
Average Mass 366.454
Monoisotopic Mass 366.20424
InChI InChI=1S/C20H30O6/c21-17(11-6-2-1-3-9-15-19(23)24)12-7-4-5-8-13-18(22)14-10-16-20(25)26/h2,4-6,8,13,18,22H,1,3,7,9-12,14-16H2,(H,23,24)(H,25,26)/b5-4+,6-2-,13-8-/t18-/m0/s1
InChIKey RYMSXFPLTLWXCK-VJNSNPJLSA-N
SMILES O[C@H](CCCC(O)=O)/C=C\C=C\CCC(=O)C/C=C\CCCCC(O)=O
Roles Classification
Chemical Role(s): Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Bronsted base).
(via oxoacid )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing 12-oxo-10,11-dihydro-20-COOH-LTB4 (CHEBI:175705) is a long-chain fatty acid (CHEBI:15904)
IUPAC Name
(5R,6Z,8E,14Z)-5-hydroxy-12-oxoicosa-6,8,14-trienedioic acid
Manual Xrefs Databases
30776631 ChemSpider
HMDB0012549 HMDB
LMFA03020046 LIPID MAPS
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