CHEBI:199407 - Tenellic acid C

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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 Tenellic acid C
ChEBI ID CHEBI:199407
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C23H26O8
Net Charge 0
Average Mass 430.453
Monoisotopic Mass 430.16277
InChI InChI=1S/C23H26O8/c1-12(2)8-19(30-14(4)25)16-6-7-18(20(23(27)28)22(16)29-5)31-21-15(11-24)9-13(3)10-17(21)26/h6-7,9-12,19,26H,8H2,1-5H3,(H,27,28)/t19-/m0/s1
InChIKey IGGGJHYOBPGVLF-IBGZPJMESA-N
SMILES O=C(O)C1=C(OC)C(=CC=C1OC2=C(O)C=C(C)C=C2C=O)[C@@H](OC(=O)C)CC(C)C
Metabolite of Species Details
Dendrospora tenella (NCBI:txid1491030) See: PubMed
ChEBI Ontology
Outgoing Tenellic acid C (CHEBI:199407) is a aromatic ether (CHEBI:35618)
IUPAC Name
3-(1-acetyloxy-3-methylbutyl)-6-(2-ormyl-6-hydroxy-4-methylphenoxy)-2-methoxybenzoic acid
Manual Xref Database
9011683 ChemSpider
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