CHEBI:223277 - Tenellic acid D

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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 D
ChEBI ID CHEBI:223277
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C25H32O7
Net Charge 0
Average Mass 444.524
Monoisotopic Mass 444.21480
InChI InChI=1S/C25H32O7/c1-14(2)9-21(31-13-15(3)4)18-7-8-20(22(25(28)29)24(18)30-6)32-23-17(12-26)10-16(5)11-19(23)27/h7-8,10-12,14-15,21,27H,9,13H2,1-6H3,(H,28,29)/t21-/m0/s1
InChIKey RSHGBXXCFTYVDQ-NRFANRHFSA-N
SMILES O=C(O)C1=C(OC)C(=CC=C1OC2=C(O)C=C(C)C=C2C=O)[C@@H](OCC(C)C)CC(C)C
Metabolite of Species Details
Dendrospora tenella (NCBI:txid1491030) See: PubMed
ChEBI Ontology
Outgoing Tenellic acid D (CHEBI:223277) is a aromatic ether (CHEBI:35618)
IUPAC Name
6-(2-ormyl-6-hydroxy-4-methylphenoxy)-2-methoxy-3-[3-methyl-1-(2-methylpropoxy)butyl]benzoic acid
Manual Xref Database
8869945 ChemSpider
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