Chem
J-GLOBAL ID：200907054021259678   Nikkaji number：J133.128K

Dimerumic acid

ジメルム酸
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： C22H36N4O8
Molecular formula furigana： C22-H36-N4-O8
Molecular weight： 484.550
InChI： InChI=1S/C22H36N4O8/c1-15(7-11-27)13-19(29)25(33)9-3-5-17-21(31)24-18(22(32)23-17)6-4-10-26(34)20(30)14-16(2)8-12-28/h13-14,17-18,27-28,33-34H,3-12H2,1-2H3,(H,23,32)(H,24,31)
InChI key： MKDKGLNKTMDNHY-UHFFFAOYSA-N
SMILES： CC(=CC(=O)N(O)CCCC1NC(=O)C(CCCN(O)C(=O)C=C(C)CCO)NC1=O)CCO
Systematic name  (3)：
  • N,N′-[(3,6-ジオキソ-2,5-ピペラジンジイル)ジ(3,1-プロパンジイル)]ビス[N,5-ジヒドロキシ-3-メチル-2-ペンテンアミド]
  • N-(3-{5-[3-(N,5-ジヒドロキシ-3-メチルペンタ-2-エンアミド)プロピル]-3,6-ジオキソピペラジン-2-イル}プロピル)-N,5-ジヒドロキシ-3-メチルペンタ-2-エンアミド
  • N-(3-{5-[3-(N,5-dihydroxy-3-methylpent-2-enamido)propyl]-3,6-dioxopiperazin-2-yl}propyl)-N,5-dihydroxy-3-methylpent-2-enamide
Other name (5)：
  • Dimerumic acid
  • Dimerum acid
  • ジメルム酸
  • N,N′-[(3,6-Dioxo-2,5-piperazinediyl)di(3,1-propanediyl)]bis[N,5-dihydroxy-3-methyl-2-pentenamide]
  • ジメルミン酸
CAS registry number： 26912-16-3
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