CHEBI:198296 - Conidiogenone H

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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 Conidiogenone H
ChEBI ID CHEBI:198296
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C20H32O3
Net Charge 0
Average Mass 320.473
Monoisotopic Mass 320.23514
InChI InChI=1S/C20H32O3/c1-11-13(21)8-14(22)19(5)7-6-12-16-17(2,3)9-15(23)18(16,4)10-20(11,12)19/h11-13,15-16,21,23H,6-10H2,1-5H3/t11-,12-,13+,15+,16+,18-,19-,20-/m0/s1
InChIKey BOEJZQKGKUOOFY-VAZONFKMSA-N
SMILES O=C1[C@]2([C@@]3([C@@H](C)[C@@H](C1)O)[C@H]([C@@H]4C(C[C@H]([C@@]4(C3)C)O)(C)C)CC2)C
Metabolite of Species Details
Penicillium (NCBI:txid5073) See: PubMed
ChEBI Ontology
Outgoing Conidiogenone H (CHEBI:198296) is a sesquiterpenoid (CHEBI:26658)
IUPAC Name
(1R,2R,3R,6R,9S,10R,13R,14R)-3,13-dihydroxy-2,6,11,11,14-pentamethyltetracyclo[7.6.0.01,6.010,14]pentadecan-5-one
Manual Xref Database
27025632 ChemSpider
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