CHEBI:218655 - Terricolin

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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 Terricolin
ChEBI ID CHEBI:218655
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C15H21NO3.C15H21NO3.C15H21NO3.Fe
Net Charge 0
Average Mass 845.856
Monoisotopic Mass 845.39137
InChI InChI=1S/3C15H21NO3.Fe/c3*1-4-11-8-9(2)7-10(3)13(11)14-12(17)5-6-16(19)15(14)18;/h3*4-6,9-11,13,17,19H,1,7-8H2,2-3H3;/t3*9-,10+,11-,13-;/m000./s1
InChIKey NUBBNBYGRZUXBQ-PRMLXJAHSA-N
SMILES [Fe].O=C1N(O)C=CC(=C1[C@@H]2[C@@H](C=C)C[C@@H](C)C[C@H]2C)O.O=C1N(O)C=CC(=C1[C@@H]2[C@@H](C=C)C[C@@H](C)C[C@H]2C)O.O=C1N(O)C=CC(=C1[C@@H]2[C@@H](C=C)C[C@@H](C)C[C@H]2C)O
Metabolite of Species Details
Tolypocladium (NCBI:txid29909) See: PubMed
ChEBI Ontology
Outgoing Terricolin (CHEBI:218655) is a pyridone (CHEBI:38183)
IUPAC Name
3-[(1S,2R,4S,6R)-2-ethenyl-4,6-dimethylcyclohexyl]-1,4-dihydroxypyridin-2-one;iron