CHEBI:207946 - 4-[(3R,4S)-3-hydroxy-3,7-dimethylocta-1,6-dienyl(9Z, 12Z)-9,12-octadecadienoate

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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 4-[(3R,4S)-3-hydroxy-3,7-dimethylocta-1,6-dienyl(9Z, 12Z)-9,12-octadecadienoate
ChEBI ID CHEBI:207946
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C28H48O3
Net Charge 0
Average Mass 432.689
Monoisotopic Mass 432.36035
InChI InChI=1S/C28H48O3/c1-6-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-27(29)31-26(24-23-25(3)4)28(5,30)7-2/h7,11-12,14-15,23,26,30H,2,6,8-10,13,16-22,24H2,1,3-5H3/b12-11-,15-14-/t26-,28+/m0/s1
InChIKey FFIODWHMPHVNMQ-RCJNOGFCSA-N
SMILES O=C(O[C@H]([C@](O)(C=C)C)CC=C(C)C)CCCCCCC/C=C\C/C=C\CCCCC
Metabolite of Species Details
Dictyophora indusiata (NCBI:txid146777) See: DOI
ChEBI Ontology
Outgoing 4-[(3R,4S)-3-hydroxy-3,7-dimethylocta-1,6-dienyl(9Z, 12Z)-9,12-octadecadienoate (CHEBI:207946) is a lipid (CHEBI:18059)
IUPAC Name
[(3R,4S)-3-hydroxy-3,7-dimethylocta-1,6-dien-4-yl] (9Z,12Z)-octadeca-9,12-dienoate
Manual Xref Database
78437346 ChemSpider
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