Chem
J-GLOBAL ID：200907061811179573   Nikkaji number：J410.417J

Portulacaxanthin II

ポルツラカキサンチンII
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： C18H18N2O7
Molecular formula furigana： C18-H18-N2-O7
Molecular weight： 374.349
InChI： InChI=1S/C18H18N2O7/c21-12-3-1-10(2-4-12)7-13(16(22)23)19-6-5-11-8-14(17(24)25)20-15(9-11)18(26)27/h1-6,8,13,15,20-21H,7,9H2,(H,22,23)(H,24,25)(H,26,27)/t13-,15-/m0/s1
InChI key： MBFJCQLVRQZZOV-ZFWWWQNUSA-N
SMILES： OC(=O)[C@H](Cc1ccc(O)cc1)N=CC=C1C[C@H](NC(=C1)C(=O)O)C(=O)O
Systematic name  (3)：
  • N-[2-[[(2S)-2α,6-ジカルボキシ-1,2,3,4-テトラヒドロピリジン]-4-イリデン]エチリデン]-L-チロシン
  • (2S)-4-(2-{[(1S)-1-カルボキシ-2-(4-ヒドロキシフェニル)エチル]イミノ}エチリデン)-1,2,3,4-テトラヒドロピリジン-2,6-ジカルボン酸
  • (2S)-4-(2-{[(1S)-1-carboxy-2-(4-hydroxyphenyl)ethyl]imino}ethylidene)-1,2,3,4-tetrahydropyridine-2,6-dicarboxylic acid
Other name (5)：
  • ポルツラカキサンチンII
  • Portulacaxanthin II
  • N-[2-[[(2S)-2α,6-Dicarboxy-1,2,3,4-tetrahydropyridin]-4-ylidene]ethylidene]-L-tyrosine
  • (R)-Tyrosine-betaxanthin
  • (R)-チロシン-ベタキサンチン
KEGG COMPOUND： C08565
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