Chem
J-GLOBAL ID：200907074860781712   Nikkaji number：J6.003H

Cinchonidine

シンコニジン
Substance type：
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula： C19H22N2O
Molecular formula furigana： C19-H22-N2-O
Molecular weight： 294.398
InChI： InChI=1S/C19H22N2O/c1-2-13-12-21-10-8-14(13)11-18(21)19(22)16-7-9-20-17-6-4-3-5-15(16)17/h2-7,9,13-14,18-19,22H,1,8,10-12H2/t13-,14-,18-,19+/m0/s1
InChI key： KMPWYEUPVWOPIM-KODHJQJWSA-N
SMILES： O[C@@H]([C@@H]1C[C@@H]2CCN1C[C@@H]2C=C)c1ccnc2ccccc12
Systematic name  (3)：
  • (8S,9R)-シンコナン-9-オール
  • (8α,9R)-シンコナン-9-オール
  • (8S,9R)-9-ヒドロキシシンコナン
Other name (13)：
  • α-キニジン
  • シンコニジン
  • シンコバチン
  • α-Quinidine
  • Cinchonidine
Show all
CAS registry number： 485-71-2
Regulation number (4)：
  • (9)-501
  • GD2975000
  • EINECS2076223
  • TSCA(485-71-2)
KEGG COMPOUND： C11379
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