CHEBI:199265 - Gliocladride

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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 Gliocladride
ChEBI ID CHEBI:199265
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C22H30N2O3
Net Charge 0
Average Mass 370.493
Monoisotopic Mass 370.22564
InChI InChI=1S/C22H30N2O3/c1-15(2)6-5-7-16(3)12-13-27-19-10-8-18(9-11-19)14-20-22(26)23-17(4)21(25)24-20/h6,8-12,17,20H,5,7,13-14H2,1-4H3,(H,23,26)(H,24,25)/b16-12+/t17-,20-/m0/s1
InChIKey WNQHFIWBXDAPMW-YSDUMNIHSA-N
SMILES O=C1N[C@H](C(=O)N[C@H]1CC2=CC=C(OC/C=C(/CCC=C(C)C)\C)C=C2)C
Metabolite of Species Details
Gliocladiumspecies (NCBI:txid1955101) See: PubMed
ChEBI Ontology
Outgoing Gliocladride (CHEBI:199265) is a monoterpenoid (CHEBI:25409)
IUPAC Name
(3S,6S)-3-[[4-[(2E)-3,7-dimethylocta-2,6-dienoxy]phenyl]methyl]-6-methylpiperazine-2,5-dione
Manual Xref Database
20564505 ChemSpider
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