CHEBI:224789 - Pannomycin

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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 Pannomycin
ChEBI ID CHEBI:224789
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C22H32O3
Net Charge 0
Average Mass 344.495
Monoisotopic Mass 344.23514
InChI InChI=1S/C22H32O3/c1-6-7-18-15(3)10-17-11-16(4)20(23)12-19(17)22(18,5)13-14(2)8-9-21(24)25/h6-10,13,16-20,23H,11-12H2,1-5H3,(H,24,25)/b7-6+,9-8+,14-13+/t16-,17-,18-,19+,20+,22+/m0/s1
InChIKey FFRJHWIQULDGGE-CUYCTCHZSA-N
SMILES O=C(O)/C=C/C(=C/[C@@]1([C@H](C(=C[C@@H]2[C@H]1C[C@@H](O)[C@H](C2)C)C)/C=C/C)C)/C
Metabolite of Species Details
Pseudogymnoascus pannorum (NCBI:txid79858) See: PubMed
ChEBI Ontology
Outgoing Pannomycin (CHEBI:224789) is a monoterpenoid (CHEBI:25409)
IUPAC Name
(2E,4E)-5-[(1R,2S,4aR,6S,7R,8aR)-7-hydroxy-1,3,6-trimethyl-2-[(E)-prop-1-enyl]-4a,5,6,7,8,8a-hexahydro-2H-naphthalen-1-yl]-4-methylpenta-2,4-dienoic acid
Manual Xref Database
24625500 ChemSpider
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