Chem
J-GLOBAL ID:200907081476708087
Nikkaji number:J2.035.692H
4,4′-Dithiobis[(S)-2-(tert-butoxycarbonylamino)butyric acid methyl] ester
Boc-L-Hcy(1)-OMe=Boc-L-Hcy(1)-OMe
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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:
C20 H36 N2 O8 S2
Molecular formula furigana:
C20-H36-N2-O8-S2
Molecular weight:
496.630
InChI:
InChI=1S/C20H36N2O8S2/c1-19(2,3)29-17(25)21-13(15(23)27-7)9-11-31-32-12-10-14(16(24)28-8)22-18(26)30-20(4,5)6/h13-14H,9-12H2,1-8H3,(H,21,25)(H,22,26)/t13-,14-/m0/s1
InChI key:
IXVFCNHFBRIZNT-KBPBESRZSA-N
SMILES:
COC(=O)[C@H](CCSSCC[C@H](NC(=O)OC(C)(C)C)C(=O)OC)NC(=O)OC(C)(C)C
Systematic name (4):
Boc-L-Hcy(1)-OMe=Boc-L-Hcy(1)-OMe
4,4′-ジチオビス[(S)-2-(tert-ブトキシカルボニルアミノ)酪酸メチル]
メチル (2S)-2-{[(tert-ブトキシ)カルボニル]アミノ}-4-{[(3S)-3-{[(tert-ブトキシ)カルボニル]アミノ}-4-メトキシ-4-オキソブチル]ジスルファニル}ブタノアート
methyl (2S)-2-{[(tert-butoxy)carbonyl]amino}-4-{[(3S)-3-{[(tert-butoxy)carbonyl]amino}-4-methoxy-4-oxobutyl]disulfanyl}butanoate
Other name (1):
4,4′-Dithiobis[(S)-2-(tert-butoxycarbonylamino)butyric acid methyl] ester
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