CHEBI:210941 - Harzianone D

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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 Harzianone D
ChEBI ID CHEBI:210941
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C20H28O2
Net Charge 0
Average Mass 300.442
Monoisotopic Mass 300.20893
InChI InChI=1S/C20H28O2/c1-11-6-7-20-12(2)14(21)8-13(18(20,3)4)9-16(20)19(5)10-15(22)17(11)19/h12-13,16H,6-10H2,1-5H3/t12-,13+,16+,19+,20-/m1/s1
InChIKey WXQXMHOAJCAANU-JOMBGVAESA-N
SMILES O=C1[C@H]([C@@]23C(C)(C)[C@@H](C1)C[C@H]2[C@]4(C(C(=O)C4)=C(CC3)C)C)C
Metabolite of Species Details
Trichoderma (NCBI:txid5543) See: PubMed
ChEBI Ontology
Outgoing Harzianone D (CHEBI:210941) is a cyclic ketone (CHEBI:3992)
IUPAC Name
(1S,8S,9S,11R,14S)-4,8,14,15,15-pentamethyltetracyclo[9.3.1.01,9.05,8]pentadec-4-ene-6,13-dione
Manual Xref Database
78315782 ChemSpider
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