CHEBI:223831 - (7R,10S)-aspergilloid H

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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 (7R,10S)-aspergilloid H
ChEBI ID CHEBI:223831
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C15H20O4
Net Charge 0
Average Mass 264.321
Monoisotopic Mass 264.13616
InChI InChI=1S/C15H20O4/c1-8(2)11-4-3-9(7-16)14-12(11)5-10(15(18)19)6-13(14)17/h5-6,8-9,11,16-17H,3-4,7H2,1-2H3,(H,18,19)/t9-,11-/m1/s1
InChIKey YJDRZMWDCQFTOS-MWLCHTKSSA-N
SMILES O=C(O)C1=CC(O)=C2[C@H](CC[C@@H](C2=C1)C(C)C)CO
Metabolite of Species Details
Aspergillus flavus (NCBI:txid5059) See: PubMed
ChEBI Ontology
Outgoing (7R,10S)-aspergilloid H (CHEBI:223831) is a sesquiterpenoid (CHEBI:26658)
IUPAC Name
(5S,8R)-4-hydroxy-5-(hydroxymethyl)-8-propan-2-yl-5,6,7,8-tetrahydronaphthalene-2-carboxylic acid
Manual Xref Database
128438102 ChemSpider
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