CHEBI:215508 - Conidiogenone E

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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 E
ChEBI ID CHEBI:215508
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C20H30O2
Net Charge 0
Average Mass 302.458
Monoisotopic Mass 302.22458
InChI InChI=1S/C20H30O2/c1-12-6-7-14(21)19(5)9-8-13-16-17(2,3)10-15(22)18(16,4)11-20(12,13)19/h6-7,12-13,15-16,22H,8-11H2,1-5H3/t12-,13-,15+,16+,18-,19-,20-/m1/s1
InChIKey IVILGQFEEVXKDO-QGKRQCMOSA-N
SMILES O=C1C=C[C@@H](C)[C@@]23[C@@]1(CC[C@@H]2[C@H]4C(C[C@@H]([C@]4(C3)C)O)(C)C)C
Metabolite of Species Details
Penicilliumspecies (NCBI:txid5081) See: DOI
ChEBI Ontology
Outgoing Conidiogenone E (CHEBI:215508) is a sesquiterpenoid (CHEBI:26658)
IUPAC Name
(1R,2R,6S,9R,10S,13S,14S)-13-hydroxy-2,6,11,11,14-pentamethyltetracyclo[7.6.0.01,6.010,14]pentadec-3-en-5-one
Manual Xref Database
78438614 ChemSpider
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