Chem
J-GLOBAL ID：200907085142509631   Nikkaji number：J868.707B

R-95867

R-95867
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： C14H18N2O5S
Molecular formula furigana： C14-H18-N2-O5-S
Molecular weight： 326.370
InChI： InChI=1S/C14H18N2O5S/c1-5-10-9(6(2)17)13(19)16(10)11(14(20)21)12(5)22-7-3-8(18)15-4-7/h5-7,9-10,17H,3-4H2,1-2H3,(H,15,18)(H,20,21)/t5-,6-,7-,9-,10-/m1/s1
InChI key： CTEFNVKDRWMZSL-CTNSIQBBSA-N
SMILES： C[C@@H](O)[C@@H]1[C@H]2[C@@H](C)C(=C(N2C1=O)C(=O)O)S[C@H]1CNC(=O)C1
Systematic name  (3)：
  • (4R,5S,6S)-6-[(R)-1-ヒドロキシエチル]-4-メチル-3-[[(3R)-5-オキソピロリジン-3-イル]チオ]-7-オキソ-1-アザビシクロ[3.2.0]ヘプタ-2-エン-2-カルボン酸
  • (4R,5S,6S)-6-[(1R)-1-ヒドロキシエチル]-4-メチル-7-オキソ-3-{[(3R)-5-オキソピロリジン-3-イル]スルファニル}-1-アザビシクロ[3.2.0]ヘプタ-2-エン-2-カルボン酸
  • (4R,5S,6S)-6-[(1R)-1-hydroxyethyl]-4-methyl-7-oxo-3-{[(3R)-5-oxopyrrolidin-3-yl]sulfanyl}-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid
Other name (2)：
  • (4R,5S,6S)-6-[(R)-1-Hydroxyethyl]-4-methyl-3-[[(3R)-5-oxopyrrolidin-3-yl]thio]-7-oxo-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid
  • R-95867
Thsaurus map：
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