CHEBI:16267 - (R)-4-hydroxymandelonitrile β-D-glucoside

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ChEBI Name (R)-4-hydroxymandelonitrile β-D-glucoside
ChEBI ID CHEBI:16267
ChEBI ASCII Name (R)-4-hydroxymandelonitrile beta-D-glucoside
Definition A β-D-glucoside consisting of (R)-prunasin carrying a hydroxy substituent at position 4 on the phenyl ring.
Stars This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs CHEBI:9418, CHEBI:15207, CHEBI:26862
Supplier Information
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Formula C14H17NO7
Net Charge 0
Average Mass 311.28732
Monoisotopic Mass 311.101
InChI InChI=1S/C14H17NO7/c15-5-9(7-1-3-8(17)4-2-7)21-14-13(20)12(19)11(18)10(6-16)22-14/h1-4,9-14,16-20H,6H2/t9-,10+,11+,12-,13+,14+/m0/s1
InChIKey NVLTYOJHPBMILU-GMDXDWKASA-N
SMILES OC[C@H]1O[C@@H](O[C@@H](C#N)c2ccc(O)cc2)[C@H](O)[C@@H](O)[C@@H]1O
ChEBI Ontology
Outgoing (R)-4-hydroxymandelonitrile β-D-glucoside (CHEBI:16267) has functional parent (R)-prunasin (CHEBI:17396)
(R)-4-hydroxymandelonitrile β-D-glucoside (CHEBI:16267) is a β-D-glucoside (CHEBI:22798)
(R)-4-hydroxymandelonitrile β-D-glucoside (CHEBI:16267) is a nitrile (CHEBI:18379)
IUPAC Name
(2R)-(β-D-glucopyranosyloxy)(4-hydroxyphenyl)acetonitrile
Synonyms Sources
(R)-4-Hydroxymandelonitrile beta-D-glucoside KEGG COMPOUND
(R)-alpha-(β-D-glucopyranosyloxy)-4-hydroxybenzeneacetonitrile ChemIDplus
(R)-p-hydroxymandelonitrile-D-glucopyranoside ChemIDplus
Taxiphyllin KEGG COMPOUND
taxiphyllin UniProt
Database Links Databases
C01855 KEGG COMPOUND
CN101112354 Patent
CN101112355 Patent
View more database links
Registry Numbers Types Sources
21401-21-8 CAS Registry Number ChemIDplus
92612 Beilstein Registry Number Beilstein
92612 Reaxys Registry Number Reaxys
Citations Waiting for Citations Types Sources
10380623 PubMed citation Europe PMC
1194256 PubMed citation Europe PMC
12711800 PubMed citation Europe PMC
16989538 PubMed citation Europe PMC
17340339 PubMed citation Europe PMC
7012151 PubMed citation Europe PMC
7458352 PubMed citation Europe PMC
Last Modified
13 November 2017