Chem
J-GLOBAL ID：200907001603515770   Nikkaji number：J785.901E

3-[5β-[2-Oxo-2-(2-oxo-2-aminoethylamino)ethylthiomethyl]-3β-pyrrolidinylthio]-4α-methyl-6β-[(R)-1-hydroxyethyl]-7-oxo-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid

3-[5β-[2-オキソ-2-(2-オキソ-2-アミノエチルアミノ)エチルチオメチル]-3β-ピロリジニルチオ]-4α-メチル-6β-[(R)-1-ヒドロキシエチル]-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
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： C19H28N4O6S2
Molecular formula furigana： C19-H28-N4-O6-S2
Molecular weight： 472.580
InChI： InChI=1S/C19H28N4O6S2/c1-8-15-14(9(2)24)18(27)23(15)16(19(28)29)17(8)31-11-3-10(21-4-11)6-30-7-13(26)22-5-12(20)25/h8-11,14-15,21,24H,3-7H2,1-2H3,(H2,20,25)(H,22,26)(H,28,29)/t8-,9-,10+,11+,14-,15?/m1/s1
InChI key： GJUTUPVAEGRDFR-OVKQJWQVSA-N
SMILES： C[C@@H](O)[C@@H]1C2[C@@H](C)C(=C(N2C1=O)C(=O)O)S[C@@H]1CN[C@H](CSCC(=O)NCC(=O)N)C1
Systematic name  (3)：
  • 3-[5β-[2-オキソ-2-(2-オキソ-2-アミノエチルアミノ)エチルチオメチル]-3β-ピロリジニルチオ]-4α-メチル-6β-[(R)-1-ヒドロキシエチル]-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,6S)-3-{[(3S,5S)-5-[({[(カルバモイルメチル)カルバモイル]メチル}スルファニル)メチル]ピロリジン-3-イル]スルファニル}-6-[(1R)-1-ヒドロキシエチル]-4-メチル-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,6S)-3-{[(3S,5S)-5-[({[(carbamoylmethyl)carbamoyl]methyl}sulfanyl)methyl]pyrrolidin-3-yl]sulfanyl}-6-[(1R)-1-hydroxyethyl]-4-methyl-7-oxo-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid
Other name (1)：
  • 3-[5β-[2-Oxo-2-(2-oxo-2-aminoethylamino)ethylthiomethyl]-3β-pyrrolidinylthio]-4α-methyl-6β-[(R)-1-hydroxyethyl]-7-oxo-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid
Thsaurus map：
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