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3-hydroxyquinine

Go to external page http://purl.obolibrary.org/obo/CHEBI_17685

Term info

Label

3-hydroxyquinine

Synonyms
  • (8alpha,9R)-6'-methoxycinchonan-3,9-diol
  • 3-Hydroxyquinine
database cross reference
Subsets

3_STAR

IUPAC NAME
(8alpha,9R)-6'-methoxycinchonan-3,9-diol [ IUPAC ]

charge

0

formula

C20H24N2O3

has alternative id

CHEBI:11838, CHEBI:1555

has obo namespace

chebi_ontology

id

CHEBI:17685

inchi

InChI=1S/C20H24N2O3/c1-3-20(24)12-22-9-7-13(20)10-18(22)19(23)15-6-8-21-17-5-4-14(25-2)11-16(15)17/h3-6,8,11,13,18-19,23-24H,1,7,9-10,12H2,2H3/t13-,18-,19+,20+/m0/s1

inchikey

BSRUJCFCZKMFMB-YGHPHNMRSA-N

mass

340.41624

monoisotopicmass

340.17869

smiles

[H][C@]1(C[C@@H]2CC[N@]1C[C@]2(O)C=C)[C@H](O)c1ccnc2ccc(OC)cc12