CHEBI:223556 - Phomanoxide

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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 Phomanoxide
ChEBI ID CHEBI:223556
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
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Formula C15H24O3
Net Charge 0
Average Mass 252.354
Monoisotopic Mass 252.17254
InChI InChI=1S/C15H24O3/c1-9-5-6-14(2,3)13-11(17-13)8-15(4)12(18-15)7-10(9)16/h5,10-13,16H,6-8H2,1-4H3/b9-5-/t10-,11-,12+,13+,15+/m0/s1
InChIKey JANPIKCILDBEHL-DSDATCPHSA-N
SMILES O1[C@@]2(C[C@@H]3O[C@H]3C(CC=C([C@H](C[C@@H]12)O)C)(C)C)C
Metabolite of Species Details
Phomaspecies (NCBI:txid1707701) See: PubMed
ChEBI Ontology
Outgoing Phomanoxide (CHEBI:223556) is a secondary alcohol (CHEBI:35681)
IUPAC Name
(1S,3R,5R,7S,8Z,12S)-3,8,11,11-tetramethyl-4,13-dioxatricyclo[10.1.0.03,5]tridec-8-en-7-ol
Manual Xref Database
58910399 ChemSpider
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