Chem
J-GLOBAL ID：201007034822164610   Nikkaji number：J2.797.012E

Deoxymyxol

デオキシミキソール
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： C40H56O2
Molecular formula furigana： C40-H56-O2
Molecular weight： 568.886
InChI： InChI=1S/C40H56O2/c1-31(19-13-21-33(3)22-15-24-35(5)27-29-38(41)40(9,10)42)17-11-12-18-32(2)20-14-23-34(4)26-28-37-36(6)25-16-30-39(37,7)8/h11-15,17-24,26-29,38,41-42H,16,25,30H2,1-10H3/b12-11+,19-13+,20-14+,22-15+,28-26+,29-27?,31-17+,32-18+,33-21+,34-23+,35-24+/t38-/m0/s1
InChI key： OMJAWWPQNWDDBQ-NJUFREIRSA-N
SMILES： C/C(=C\C=C\C=C(/C)\C=C\C=C(/C)\C=C\C1=C(C)CCCC1(C)C)/C=C/C=C(\C)/C=C/C=C(\C)/C=C[C@H](O)C(C)(C)O
Systematic name  (3)：
  • (2′S)-3′,4′-ジデヒドロ-1′,2′-ジヒドロ-1′,2′-ジヒドロキシ-β,ψ-カロテン
  • (3S,6E,8E,10E,12E,14E,16E,18E,20E,22E,24E)-2,6,10,14,19,23-ヘキサメチル-25-(2,6,6-トリメチルシクロヘキサ-1-エン-1-イル)ペンタコサ-4,6,8,10,12,14,16,18,20,22,24-ウンデカエン-2,3-ジオール
  • (3S,6E,8E,10E,12E,14E,16E,18E,20E,22E,24E)-2,6,10,14,19,23-hexamethyl-25-(2,6,6-trimethylcyclohex-1-en-1-yl)pentacosa-4,6,8,10,12,14,16,18,20,22,24-undecaene-2,3-diol
Other name (3)：
  • (2′S)-3′,4′-Didehydro-1′,2′-dihydro-1′,2′-dihydroxy-β,ψ-carotene
  • Deoxymyxol
  • デオキシミキソール
KEGG COMPOUND： C15933
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