CHEBI:202304 - Dihydroaltersolanol 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 Dihydroaltersolanol C
ChEBI ID CHEBI:202304
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C16H18O7
Net Charge 0
Average Mass 322.313
Monoisotopic Mass 322.10525
InChI InChI=1S/C16H18O7/c1-16(22)10(18)5-8-12(15(16)21)14(20)7-3-6(23-2)4-9(17)11(7)13(8)19/h3-4,8,10,12,15,17-18,21-22H,5H2,1-2H3/t8-,10+,12-,15+,16+/m0/s1
InChIKey WUYKSAOSAAJMEW-VFGZDCLOSA-N
SMILES O=C1C2=C(C(O)=CC(=C2)OC)C(=O)[C@@H]3[C@@H]1[C@@H](O)[C@](O)([C@H](O)C3)C
Metabolite of Species Details
Stemphylium globuliferum (NCBI:txid245170) See: DOI
ChEBI Ontology
Outgoing Dihydroaltersolanol C (CHEBI:202304) is a hydroxyanthraquinones (CHEBI:37485)
IUPAC Name
(2R,3R,4R,4aR,9aS)-2,3,4,8-tetrahydroxy-6-methoxy-3-methyl-2,4,4a,9a-tetrahydro-1H-anthracene-9,10-dione
Manual Xref Database
78436845 ChemSpider
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