CHEBI:9220 - Sphagnum acid

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ChEBI Name Sphagnum acid
ChEBI ID CHEBI:9220
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C11H10O5
Net Charge 0
Average Mass 222.195
Monoisotopic Mass 222.05282
InChI InChI=1S/C11H10O5/c12-9-3-1-7(2-4-9)8(5-10(13)14)6-11(15)16/h1-5,12H,6H2,(H,13,14)(H,15,16)/b8-5+
InChIKey VOWYJJSQRYBVGK-VMPITWQZSA-N
SMILES OC(=O)C\C(c1ccc(O)cc1)=C/C(O)=O
Roles Classification
Chemical Role(s): Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Bronsted base).
(via oxoacid )
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ChEBI Ontology
Outgoing Sphagnum acid (CHEBI:9220) is a hydroxycinnamic acid (CHEBI:24689)
Synonym Source
Sphagnum acid KEGG COMPOUND
Manual Xrefs Databases
C00002779 KNApSAcK
C10496 KEGG COMPOUND
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Registry Number Type Source
57100-28-4 CAS Registry Number KEGG COMPOUND
Last Modified
28 July 2014