CHEBI:200309 - Ampelanol

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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 Ampelanol
ChEBI ID CHEBI:200309
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C16H20O8
Net Charge 0
Average Mass 340.328
Monoisotopic Mass 340.11582
InChI InChI=1S/C16H20O8/c1-16(23)14(21)10-9(13(20)15(16)22)12(19)8-6(11(10)18)3-5(24-2)4-7(8)17/h3-4,9-11,13-15,17-18,20-23H,1-2H3/t9-,10-,11-,13-,14+,15+,16-/m0/s1
InChIKey WYVKBAUSAOYEHR-DQJRHUNDSA-N
SMILES O=C1C2=C(O)C=C(OC)C=C2[C@H](O)[C@@H]3[C@@H]1[C@H](O)[C@@H](O)[C@](O)(C)[C@@H]3O
Metabolite of Species Details
Ampelomycesspecies (NCBI:txid1935294) See: PubMed
ChEBI Ontology
Outgoing Ampelanol (CHEBI:200309) is a anthracenes (CHEBI:46955)
IUPAC Name
(1S,2R,3S,4R,4aS,9aR,10R)-1,2,3,4,8,10-hexahydroxy-6-methoxy-3-methyl-1,2,4,4a,9a,10-hexahydroanthracen-9-one
Manual Xref Database
28501912 ChemSpider
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