CHEBI:188031 - Chatenaytrienin 1

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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 Chatenaytrienin 1
ChEBI ID CHEBI:188031
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C35H60O2
Net Charge 0
Average Mass 512.863
Monoisotopic Mass 512.45933
InChI InChI=1S/C35H60O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-28-29-30-31-34-32-33(2)37-35(34)36/h12-13,16-17,20-21,32-33H,3-11,14-15,18-19,22-31H2,1-2H3/b13-12-,17-16-,21-20-/t33-/m0/s1
InChIKey BALJQQWVUSFUJC-LPNLFLNHSA-N
SMILES O1[C@H](C=C(CCCCCCCCCC/C=C\CC/C=C\CC/C=C\CCCCCCCCCC)C1=O)C
Metabolite of Species Details
Homo sapiens (NCBI:txid9606) Found in blood plasma (BTO:0000131). See: MetaboLights Study
ChEBI Ontology
Outgoing Chatenaytrienin 1 (CHEBI:188031) is a polyketide (CHEBI:26188)
IUPAC Name
(2S)-2-methyl-4-[(11Z,15Z,19Z)-triaconta-11,15,19-trienyl]-2H-uran-5-one
Manual Xref Database
103882800 ChemSpider
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