CHEBI:209952 - Norpupukeanane A

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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 Norpupukeanane A
ChEBI ID CHEBI:209952
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C14H22O2
Net Charge 0
Average Mass 222.328
Monoisotopic Mass 222.16198
InChI InChI=1S/C14H22O2/c1-13(2,16)9-6-10-12-8(9)7-14(10,3)5-4-11(12)15/h8-10,12,16H,4-7H2,1-3H3/t8-,9+,10+,12-,14+/m1/s1
InChIKey PXRAAQBJEYMLKX-CUAXGOPHSA-N
SMILES O=C1[C@H]2[C@H]3[C@@](C)(CC1)C[C@@H]2[C@@H](C(O)(C)C)C3
Metabolite of Species Details
Trichoderma longibrachiatum (NCBI:txid5548) See: PubMed
ChEBI Ontology
Outgoing Norpupukeanane A (CHEBI:209952) is a monoterpenoid (CHEBI:25409)
IUPAC Name
(1S,2R,6S,8R,9S)-9-(2-hydroxypropan-2-yl)-6-methyltricyclo[4.4.0.02,8]decan-3-one
Manual Xref Database
81424708 ChemSpider
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