Chem
J-GLOBAL ID：200907054410636703   Nikkaji number：J9.353J

Purpuric acid

プルプル酸
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： C8H5N5O6
Molecular formula furigana： C8-H5-N5-O6
Molecular weight： 267.157
InChI： InChI=1S/C8H5N5O6/c14-3-1(4(15)11-7(18)10-3)9-2-5(16)12-8(19)13-6(2)17/h1H,(H2,10,11,14,15,18)(H2,12,13,16,17,19)
InChI key： VQTZGUYEOZNKQH-UHFFFAOYSA-N
SMILES： O=C1NC(=O)C(N=C2C(=O)NC(=O)NC2=O)C(=O)N1
Systematic name  (4)：
  • 5-[(ヘキサヒドロ-2,4,6-トリオキソピリミジン-5-イル)イミノ]-2,4,6(1H,3H,5H)-ピリミジントリオン
  • 5-[(ヘキサヒドロ-2,4,6-トリオキソピリミジン-5-イル)イミノ]ピリミジン-2,4,6(1H,3H,5H)-トリオン
  • 5-[(2,4,6-トリオキソ-1,3-ジアジナン-5-イリデン)アミノ]-1,3-ジアジナン-2,4,6-トリオン
  • 5-[(2,4,6-trioxo-1,3-diazinan-5-ylidene)amino]-1,3-diazinane-2,4,6-trione
Other name (4)：
  • プルプル酸
  • Purpuric acid
  • 5-[(Hexahydro-2,4,6-trioxopyrimidin-5-yl)imino]-2,4,6(1H,3H,5H)-pyrimidinetrione
  • 5-[(Hexahydro-2,4,6-trioxopyrimidine-5-yl)imino]pyrimidine-2,4,6(1H,3H,5H)-trione
CAS registry number： 121-08-4
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