Chem
J-GLOBAL ID：200907040307156042   Nikkaji number：J1.464.539J

Diadinochrome

ジアジノクロム
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： C40H54O
Molecular formula furigana： C40-H54-O
Molecular weight： 550.871
InChI： InChI=1S/C40H54O/c1-30(19-13-20-32(3)24-25-35-33(4)23-15-26-38(35,6)7)17-11-12-18-31(2)21-14-22-34(5)36-29-37-39(8,9)27-16-28-40(37,10)41-36/h11-14,17-22,29,36H,15-16,23,26-28H2,1-10H3/b12-11+,19-13+,21-14+,30-17+,31-18+,32-20+,34-22+
InChI key： CZPJMPMUASOMES-NEFHIMGMSA-N
SMILES： C/C(=C\C=C\C=C(/C)\C=C\C=C(/C)\C1OC2(C)CCCC(C)(C)C2=C1)/C=C/C=C(\C)/C#CC1=C(C)CCCC1(C)C
Systematic name  (3)：
  • 7′,8′-ジデヒドロ-5,8-エポキシ-5,8-ジヒドロ-β,β-カロテン
  • 4,4,7a-トリメチル-2-[(2E,4E,6E,8E,10E,12E,14E)-6,11,15-トリメチル-17-(2,6,6-トリメチルシクロヘキサ-1-エン-1-イル)ヘプタデカ-2,4,6,8,10,12,14-ヘプタエン-16-イン-2-イル]-2,4,5,6,7,7a-ヘキサヒドロ-1-ベンゾフラン
  • 4,4,7a-trimethyl-2-[(2E,4E,6E,8E,10E,12E,14E)-6,11,15-trimethyl-17-(2,6,6-trimethylcyclohex-1-en-1-yl)heptadeca-2,4,6,8,10,12,14-heptaen-16-yn-2-yl]-2,4,5,6,7,7a-hexahydro-1-benzofuran
Other name (3)：
  • 7′,8′-Didehydro-5,8-epoxy-5,8-dihydro-β,β-carotene
  • Diadinochrome
  • ジアジノクロム
CAS registry number： 24381-84-8
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