Chem
J-GLOBAL ID：200907043826629267   Nikkaji number：J304.397E

Mutatoxanthin

ムタトキサンチン
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/c1-28(17-13-18-30(3)21-22-35-32(5)23-33(41)25-38(35,6)7)15-11-12-16-29(2)19-14-20-31(4)36-24-37-39(8,9)26-34(42)27-40(37,10)43-36/h11-22,24,33-34,36,41-42H,23,25-27H2,1-10H3/b12-11+,17-13+,19-14+,22-21+,28-15+,29-16+,30-18+,31-20+/t33-,34+,36?,40-/m1/s1
InChI key： IFYMEZNJCAQUME-HHBFRJADSA-N
SMILES： C/C(=C\C=C\C=C(/C)\C=C\C=C(/C)\C1O[C@]2(C)C[C@@H](O)CC(C)(C)C2=C1)/C=C/C=C(\C)/C=C/C1=C(C)C[C@@H](O)CC1(C)C
Systematic name  (3)：
  • (3S,3′R,5R)-5,8-エポキシ-5,8-ジヒドロ-β,β-カロテン-3,3′-ジオール
  • (6S,7aR)-2-[(2E,4E,6E,8E,10E,12E,14E,16E)-17-[(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]-6,11,15-トリメチルヘプタデカ-2,4,6,8,10,12,14,16-オクタエン-2-イル]-4,4,7a-トリメチル-2,4,5,6,7,7a-ヘキサヒドロ-1-ベンゾフラン-6-オール
  • (6S,7aR)-2-[(2E,4E,6E,8E,10E,12E,14E,16E)-17-[(4R)-4-hydroxy-2,6,6-trimethylcyclohex-1-en-1-yl]-6,11,15-trimethylheptadeca-2,4,6,8,10,12,14,16-octaen-2-yl]-4,4,7a-trimethyl-2,4,5,6,7,7a-hexahydro-1-benzofuran-6-ol
Other name (3)：
  • ムタトキサンチン
  • Mutatoxanthin
  • (3S,3′R,5R)-5,8-Epoxy-5,8-dihydro-β,β-carotene-3,3′-diol
Thsaurus map：
Thesaurus Map

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