CHEBI:225385 - Penerpene F

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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 Penerpene F
ChEBI ID CHEBI:225385
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C24H27NO3
Net Charge 0
Average Mass 377.484
Monoisotopic Mass 377.19909
InChI InChI=1S/C24H27NO3/c1-22-9-8-20-18(12-15(26)13-28-20)24(22,27)10-7-14-11-17-16-5-3-4-6-19(16)25-21(17)23(14,22)2/h3-6,12,14,20,25,27H,7-11,13H2,1-2H3/t14-,20-,22+,23+,24+/m0/s1
InChIKey KKNOIEHWIXJKBK-ZAJLXLGHSA-N
SMILES O=C1C=C2[C@@]3(O)[C@@]([C@]4(C=5NC=6C=CC=CC6C5C[C@@H]4CC3)C)(CC[C@@H]2OC1)C
Metabolite of Species Details
Penicillium (NCBI:txid5073) See: PubMed
ChEBI Ontology
Outgoing Penerpene F (CHEBI:225385) is a organic heterotricyclic compound (CHEBI:26979)
Penerpene F (CHEBI:225385) is a organooxygen compound (CHEBI:36963)
IUPAC Name
(1S,2R,5S,11S,14S)-11-hydroxy-1,2-dimethyl-6-oxa-23-azahexacyclo[12.10.0.02,11.05,10.016,24.017,22]tetracosa-9,16(24),17,19,21-pentaen-8-one
Manual Xref Database
81360787 ChemSpider
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