Chem
J-GLOBAL ID：200907019600094664   Nikkaji number：J17.328B

Siphonaxanthin

シホナキサンチン
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： C40H56O4
Molecular formula furigana： C40-H56-O4
Molecular weight： 600.884
InChI： InChI=1S/C40H56O4/c1-28(16-12-17-30(3)20-21-36-31(4)22-34(42)25-39(36,6)7)14-10-11-15-29(2)18-13-19-33(27-41)38(44)24-37-32(5)23-35(43)26-40(37,8)9/h10-22,34-36,41-43H,23-27H2,1-9H3/b11-10+,16-12+,18-13+,21-20+,28-14+,29-15+,30-17+,33-19+/t34-,35+,36-/m0/s1
InChI key： SUCKEYMKNGZJHK-ZARIWKGHSA-N
SMILES： C/C(=C\C=C\C=C(/C)\C=C\C=C(/CO)\C(=O)CC1=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)-7,8-ジヒドロ-8-オキソ-β,ε-カロテン-3,3′,19-トリオール
  • (3E,5E,7E,9E,11E,13E,15E,17E)-1-[(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]-18-[(1R,4R)-4-ヒドロキシ-2,6,6-トリメチルシクロヘキサ-2-エン-1-イル]-3-(ヒドロキシメチル)-7,12,16-トリメチルオクタデカ-3,5,7,9,11,13,15,17-オクタエン-2-オン
  • (3E,5E,7E,9E,11E,13E,15E,17E)-1-[(4R)-4-hydroxy-2,6,6-trimethylcyclohex-1-en-1-yl]-18-[(1R,4R)-4-hydroxy-2,6,6-trimethylcyclohex-2-en-1-yl]-3-(hydroxymethyl)-7,12,16-trimethyloctadeca-3,5,7,9,11,13,15,17-octaen-2-one
Other name (4)：
  • シホナキサンチン
  • Siphonaxanthin
  • (3R,3′R,6′R)-7,8-Dihydro-8-oxo-β,ε-carotene-3,3′,19-triol
  • シフォナキサンチン
CAS registry number： 28526-44-5
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