Chem
J-GLOBAL ID：200907090976072145   Nikkaji number：J430.622H

Loroxanthin

ロロキサンチン
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： C40H56O3
Molecular formula furigana： C40-H56-O3
Molecular weight： 584.885
InChI： InChI=1S/C40H56O3/c1-29(16-12-17-31(3)20-22-37-32(4)24-35(42)26-39(37,6)7)14-10-11-15-30(2)18-13-19-34(28-41)21-23-38-33(5)25-36(43)27-40(38,8)9/h10-24,35-37,41-43H,25-28H2,1-9H3/b11-10+,16-12+,18-13+,22-20+,23-21+,29-14+,30-15+,31-17+,34-19-/t35-,36+,37-/m0/s1
InChI key： ODGGKCNQKSEQNL-CWBMHJDKSA-N
SMILES： C/C(=C\C=C\C=C(/C)\C=C\C=C(/CO)\C=C\C1=C(C)C[C@@H](O)CC1(C)C)/C=C/C=C(\C)/C=C/[C@H]1C(=C[C@H](O)CC1(C)C)C
Systematic name  (3)：
  • (3R,3′R,6′R)-β,ε-カロテン-3,3′,19-トリオール
  • (1R,4R)-4-[(1E,3E,5E,7E,9E,11E,13E,15Z)-17-ヒドロキシ-16-[(1E)-2-[(4R)-4-ヒドロキシ-2,6,6-トリメチルシクロヘキサ-1-エン-1-イル]エテニル]-3,7,12-トリメチルヘプタデカ-1,3,5,7,9,11,13,15-オクタエン-1-イル]-3,5,5-トリメチルシクロヘキサ-2-エン-1-オール
  • (1R,4R)-4-[(1E,3E,5E,7E,9E,11E,13E,15Z)-17-hydroxy-16-[(1E)-2-[(4R)-4-hydroxy-2,6,6-trimethylcyclohex-1-en-1-yl]ethenyl]-3,7,12-trimethylheptadeca-1,3,5,7,9,11,13,15-octaen-1-yl]-3,5,5-trimethylcyclohex-2-en-1-ol
Other name (3)：
  • ロロキサンチン
  • Loroxanthin
  • (3R,3′R,6′R)-β,ε-Carotene-3,3′,19-triol
Thsaurus map：
Thesaurus Map

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