Chem
J-GLOBAL ID：200907008342473025   Nikkaji number：J1.419.064C

Crinatusin A1

クリナツシンA1
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： C28H34O4
Molecular formula furigana： C28-H34-O4
Molecular weight： 434.576
InChI： InChI=1S/C28H34O4/c1-17(2)10-9-11-20-14-15-22(23(16-20)21-12-7-6-8-13-21)27(31)24-26(30)18(3)25(29)19(4)28(24)32-5/h6-8,10,12-14,22-23,29-30H,9,11,15-16H2,1-5H3/t22?,23-/m0/s1
InChI key： NDZMOXYPYAVMQI-WCSIJFPASA-N
SMILES： COc1c(C)c(O)c(C)c(O)c1C(=O)C1CC=C(CCC=C(C)C)C[C@H]1c1ccccc1
Systematic name  (3)：
  • (2-メトキシ-3,5-ジメチル-4,6-ジヒドロキシフェニル)[(6R)-4-(4-メチル-3-ペンテニル)-6-フェニル-3-シクロヘキセニル]ケトン
  • 5-メトキシ-2,4-ジメチル-6-[(6R)-4-(4-メチルペンタ-3-エン-1-イル)-6-フェニルシクロヘキサ-3-エン-1-カルボニル]ベンゼン-1,3-ジオール
  • 5-methoxy-2,4-dimethyl-6-[(6R)-4-(4-methylpent-3-en-1-yl)-6-phenylcyclohex-3-ene-1-carbonyl]benzene-1,3-diol
Other name (3)：
  • (2-Methoxy-3,5-dimethyl-4,6-dihydroxyphenyl)[(6R)-4-(4-methyl-3-pentenyl)-6-phenyl-3-cyclohexenyl] ketone
  • クリナツシンA1
  • Crinatusin A1
Thsaurus map：
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