CHEBI:223608 - Daldispone B

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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 Daldispone B
ChEBI ID CHEBI:223608
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C17H30O4
Net Charge 0
Average Mass 298.423
Monoisotopic Mass 298.21441
InChI InChI=1S/C17H30O4/c1-3-4-5-6-7-8-9-10-11-17(20)14(13-18)15(21-2)12-16(17)19/h12,14,18,20H,3-11,13H2,1-2H3/t14-,17-/m0/s1
InChIKey MZACQKHHYNDICZ-YOEHRIQHSA-N
SMILES O=C1C=C(OC)[C@@H]([C@@]1(O)CCCCCCCCCC)CO
Metabolite of Species Details
Daldinia (NCBI:txid42360) See: PubMed
ChEBI Ontology
Outgoing Daldispone B (CHEBI:223608) is a long-chain fatty alcohol (CHEBI:17135)
IUPAC Name
(4R,5S)-5-decyl-5-hydroxy-4-(hydroxymethyl)-3-methoxycyclopent-2-en-1-one