Chem
J-GLOBAL ID：200907086311254970   Nikkaji number：J227.500G

Molybdopterin

モリブドプテリン
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： C10H14N5O6PS2
Molecular formula furigana： C10-H14-N5-O6-P-S2
Molecular weight： 395.340
InChI： InChI=1S/C10H14N5O6PS2/c11-10-14-8-5(9(17)15-10)13-3(1-12-8)6(23)7(24)4(16)2-21-22(18,19)20/h1,4,13,16,23-24H,2H2,(H2,18,19,20)(H4,11,12,14,15,17)
InChI key： AARMQWMPBSVRAR-UHFFFAOYSA-N
SMILES： Nc1nc(=O)c2[nH]c(c[nH]c2[nH]1)C(=C(S)C(O)COP(=O)(O)O)S
Systematic name  (3)：
  • 2-アミノ-5,8-ジヒドロ-6-(3-ヒドロキシ-1,2-ジメルカプト-4-ホスホノオキシ-1-ブテニル)-4(1H)-プテリジノン
  • {[4-(2-アミノ-4-オキソ-1,4,5,8-テトラヒドロプテリジン-6-イル)-2-ヒドロキシ-3,4-ジスルファニルブタ-3-エン-1-イル]オキシ}ホスホン酸
  • {[4-(2-amino-4-oxo-1,4,5,8-tetrahydropteridin-6-yl)-2-hydroxy-3,4-disulfanylbut-3-en-1-yl]oxy}phosphonic acid
Other name (3)：
  • モリブドプテリン
  • Molybdopterin
  • 2-Amino-5,8-dihydro-6-(3-hydroxy-1,2-dimercapto-4-phosphonooxy-1-butenyl)-4(1H)-pteridinone
CAS registry number： 89700-34-5
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