CHEBI:218057 - Fusahydronaphthalene

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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 Fusahydronaphthalene
ChEBI ID CHEBI:218057
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C17H26O
Net Charge 0
Average Mass 246.394
Monoisotopic Mass 246.19837
InChI InChI=1S/C17H26O/c1-5-6-15-9-8-14-11-12(2)7-10-16(14)17(15,4)13(3)18/h5-6,8-9,12,14-16H,7,10-11H2,1-4H3/b6-5+/t12-,14-,15-,16-,17-/m0/s1
InChIKey ZMNUQXHKKBCKLT-ZQIFJLEOSA-N
SMILES O=C([C@]1([C@H](C=C[C@@H]2[C@@H]1CC[C@@H](C2)C)/C=C/C)C)C
Metabolite of Species Details
Fusariumspecies PSU-ES123 (NCBI:txid1608752) See: DOI
ChEBI Ontology
Outgoing Fusahydronaphthalene (CHEBI:218057) is a ketone (CHEBI:17087)
IUPAC Name
1-[(1R,2S,4aR,6S,8aS)-1,6-dimethyl-2-[(E)-prop-1-enyl]-4a,5,6,7,8,8a-hexahydro-2H-naphthalen-1-yl]ethanone
Manual Xref Database
58197254 ChemSpider
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