Chem
J-GLOBAL ID：200907021626576173   Nikkaji number：J1.392.393K

(12,13,14,15,20-13C5)Retinal

(12,13,14,15,20-13C5)レチナール
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： C15[13C]5H28O
Molecular formula furigana： C20-H28-O
Molecular weight： 289.405
InChI： InChI=1S/C20H28O/c1-16(8-6-9-17(2)13-15-21)11-12-19-18(3)10-7-14-20(19,4)5/h6,8-9,11-13,15H,7,10,14H2,1-5H3/b9-6+,12-11+,16-8+,17-13+/i2+1,9+1,13+1,15+1,17+1
InChI key： NCYCYZXNIZJOKI-PEHZNMDESA-N
SMILES： C/C(=C\C=[13CH]\[13C](=[13CH]\[13CH]=O)\[13CH3])/C=C/C1=C(C)CCCC1(C)C
Systematic name  (3)：
  • (12,13,14,15,20-13C5)レチナール
  • (2E,4E,6E,8E)-3-(13C)メチル-7-メチル-9-(2,6,6-トリメチルシクロヘキサ-1-エン-1-イル)(1,2,3,4-13C4)ノナ-2,4,6,8-テトラエナール
  • (2E,4E,6E,8E)-3-(13C)methyl-7-methyl-9-(2,6,6-trimethylcyclohex-1-en-1-yl)(1,2,3,4-13C4)nona-2,4,6,8-tetraenal
Other name (1)：
  • (12,13,14,15,20-13C5)Retinal
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