Terminology Service for NFDI4Health

2'-O-acetylsalicin

Go to external page http://purl.obolibrary.org/obo/CHEBI_137481


Term info

Label

2'-O-acetylsalicin

Synonyms
  • 2-(hydroxymethyl)phenyl 2-O-acetyl-beta-D-glucopyranoside
Subsets

2_STAR

IUPAC NAME
2-(hydroxymethyl)phenyl 2-O-acetyl-beta-D-glucopyranoside [ IUPAC ]

charge

0

formula

C15H20O8

has obo namespace

chebi_ontology

id

CHEBI:137481

inchi

InChI=1S/C15H20O8/c1-8(18)21-14-13(20)12(19)11(7-17)23-15(14)22-10-5-3-2-4-9(10)6-16/h2-5,11-17,19-20H,6-7H2,1H3/t11-,12-,13+,14-,15-/m1/s1

inchikey

RRRGZNGWWIEOLB-UXXRCYHCSA-N

mass

328.315

monoisotopicmass

328.11582

smiles

[C@@H]1(OC=2C(=CC=CC2)CO)O[C@@H]([C@@H](O)[C@@H]([C@H]1OC(=O)C)O)CO

Term relations