Chem
J-GLOBAL ID：200907025129817790   Nikkaji number：J819.703B

Pantetheine 4′-phosphate

パンテテイン4′-りん酸
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： C11H23N2O7PS
Molecular formula furigana： C11-H23-N2-O7-P-S
Molecular weight： 358.350
InChI： InChI=1S/C11H23N2O7PS/c1-11(2,7-20-21(17,18)19)9(15)10(16)13-4-3-8(14)12-5-6-22/h9,15,22H,3-7H2,1-2H3,(H,12,14)(H,13,16)(H2,17,18,19)/t9-/m0/s1
InChI key： JDMUPRLRUUMCTL-VIFPVBQESA-N
SMILES： CC(C)(COP(=O)(O)O)[C@@H](O)C(=O)NCCC(=O)NCCS
Systematic name  (5)：
  • (R)-2-ヒドロキシ-4-(ホスホノオキシ)-N-[3-[(2-メルカプトエチル)アミノ]-3-オキソプロピル]-3,3-ジメチルブタンアミド
  • (R)-N-[3-[(2-メルカプトエチル)アミノ]-3-オキソプロピル]-2-ヒドロキシ-3,3-ジメチル-4-(ホスホノオキシ)ブタンアミド
  • N-(2-メルカプトエチル)-Nβ-[(R)-2-ヒドロキシ-3,3-ジメチル-4-(ホスホノオキシ)ブチリル]-β-アラニンアミド
  • [(3R)-3-ヒドロキシ-2,2-ジメチル-3-({2-[(2-スルファニルエチル)カルバモイル]エチル}カルバモイル)プロポキシ]ホスホン酸
  • [(3R)-3-hydroxy-2,2-dimethyl-3-({2-[(2-sulfanylethyl)carbamoyl]ethyl}carbamoyl)propoxy]phosphonic acid
Other name (5)：
  • パンテテイン4′-りん酸
  • Pantetheine 4′-phosphate
  • (R)-2-Hydroxy-4-(phosphonooxy)-N-[3-[(2-mercaptoethyl)amino]-3-oxopropyl]-3,3-dimethylbutanamide
  • (R)-N-[3-[(2-Mercaptoethyl)amino]-3-oxopropyl]-2-hydroxy-3,3-dimethyl-4-(phosphonooxy)butanamide
  • N-(2-Mercaptoethyl)-Nβ-[(R)-2-hydroxy-3,3-dimethyl-4-(phosphonooxy)butyryl]-β-alaninamide
Thsaurus map：
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