Ontologiesโ–ธmicroโ–ธclassesโ–ธCHEBI:91211   
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glycosmisic acid 4'-sulfateImported
http://purl.obolibrary.org/obo/CHEBI_91211

A guaiacyl lignin that is glycosmisic acid in which the phenolic hydrogen is replaced by a sulfo group.

Defined bychebi
Also appears inslm
Exact Synonyms
(2E)-3-{3-(hydroxymethyl)-7-methoxy-2-[3-methoxy-4-(sulfooxy)phenyl]-2,3-dihydro-1-benzofuran-5-yl}prop-2-enoic acid
Related Synonyms
G(8-5)FA Sulfate
class Information
formula

C20H20O10S

has_dbxref

PMID:25457500

has_obo_namespace

chebi_ontology

inchi

InChI=1S/C20H20O10S/c1-27-16-9-12(4-5-15(16)30-31(24,25)26)19-14(10-21)13-7-11(3-6-18(22)23)8-17(28-2)20(13)29-19/h3-9,14,19,21H,10H2,1-2H3,(H,22,23)(H,24,25,26)/b6-3+

inchikey

VDMHTGWQLREBFW-ZZXKWVIFSA-N

mass

452.434

monoisotopicmass

452.078

smiles

C=12OC(C(C1C=C(C=C2OC)/C=C/C(O)=O)CO)C3=CC(=C(C=C3)OS(O)(=O)=O)OC

class Relations