CHEBI:167189 - (3R,5R,7S,8E,10E,12E)-3-amino-5,7-dihydroxyoctadeca-8,10,12-trienoic acid

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name (3R,5R,7S,8E,10E,12E)-3-amino-5,7-dihydroxyoctadeca-8,10,12-trienoic acid
ChEBI ID CHEBI:167189
Stars This entity has been manually annotated by a third party.
Submitter LIKUI FENG
Supplier Information
Download Molfile XML SDF
Formula C18H31NO4
Net Charge 0
Average Mass 325.449
Monoisotopic Mass 325.22531
InChI InChI=1S/C18H31NO4/c1-2-3-4-5-6-7-8-9-10-11-16(20)14-17(21)12-15(19)13-18(22)23/h6-11,15-17,20-21H,2-5,12-14,19H2,1H3,(H,22,23)/b7-6+,9-8+,11-10+/t15-,16-,17-/m1/s1
InChIKey RIELEJUDWWNVHS-JGYKGMOYSA-N
SMILES C(=C\[C@H](C[C@@H](C[C@H](CC(O)=O)N)O)O)/C=C/C=C/CCCCC
Metabolite of Species Details
Caenorhabditis elegans (NCBI:txid6239) See: MetaboLights Study
ChEBI Ontology
Outgoing (3R,5R,7S,8E,10E,12E)-3-amino-5,7-dihydroxyoctadeca-8,10,12-trienoic acid (CHEBI:167189) is a organic molecular entity (CHEBI:50860)