CHEBI:66258 - torvanol A

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ChEBI Name torvanol A
ChEBI ID CHEBI:66258
Definition An organic potassium salt of torvanol A hydrogen sulfate. Isolated from the fruits of Solanum torvum, it exhibits antiviral activity against herpes simplex virus type 1.
Stars This entity has been manually annotated by the ChEBI Team.
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Formula C20H19KO10S
Net Charge 0
Average Mass 490.52200
Monoisotopic Mass 490.03360
InChI InChI=1S/C20H20O10S.K/c1-27-12-4-5-16-14(9-12)20(30-31(24,25)26)15(10-29-16)13-7-11(3-6-18(21)22)8-17(28-2)19(13)23;/h3-9,15,20,23H,10H2,1-2H3,(H,21,22)(H,24,25,26);/q;+1/p-1/b6-3+;/t15-,20+;/m0./s1
InChIKey OYAPXMLXMKSIDT-WSCZMHPESA-M
SMILES [K+].COc1ccc2OC[C@H]([C@H](OS([O-])(=O)=O)c2c1)c1cc(\C=C\C(O)=O)cc(OC)c1O
Metabolite of Species Details
Solanum torvum (NCBI:txid119830) Found in fruit (BTO:0000486). See: PubMed
Roles Classification
Biological Role(s): anti-HSV-1 agent
An anti-HSV agent agent that destroys or inhibits the replication of herpes simplex virus-1.
plant metabolite
Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing torvanol A (CHEBI:66258) has part torvanol A(1−) (CHEBI:83882)
torvanol A (CHEBI:66258) has role anti-HSV-1 agent (CHEBI:64953)
torvanol A (CHEBI:66258) has role plant metabolite (CHEBI:76924)
torvanol A (CHEBI:66258) is a organic potassium salt (CHEBI:50394)
IUPAC Name
rel-potassium (3R,4S)-3-{5-[(E)-2-carboxyethenyl]-2-hydroxy-3-methoxyphenyl}-6-methoxy-3,4-dihydro-2H-chromen-4-yl sulfate
Registry Number Type Source
9178609 Reaxys Registry Number Reaxys
Citation Waiting for Citations Type Source
11830167 PubMed citation Europe PMC
Last Modified
26 November 2014