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N-[(1S)-1-Carboxy-3-(methylsulfanyl)propyl]-N-(3-{[(1S)-1-carboxy-3-(methylsulfanyl)propyl]amino}-3-oxopropanoyl)-4-nitro-N-(4-nitrophenyl)anilinium
[CAS# 87498-80-4]

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CAS#: 87498-80-4
Product: N-[(1S)-1-Carboxy-3-(methylsulfanyl)propyl]-N-(3-{[(1S)-1-carboxy-3-(methylsulfanyl)propyl]amino}-3-oxopropanoyl)-4-nitro-N-(4-nitrophenyl)anilinium
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Identification
Name N-[(1S)-1-Carboxy-3-(methylsulfanyl)propyl]-N-(3-{[(1S)-1-carboxy-3-(methylsulfanyl)propyl]amino}-3-oxopropanoyl)-4-nitro-N-(4-nitrophenyl)anilinium
Synonyms Malonyl-(met-onp)2; Malonylbis(methionyl-4-nitrophenyl ester)
Molecular Structure CAS#: 87498-80-4, N-[(1S)-1-Carboxy-3-(methylsulfanyl)propyl]-N-(3-{[(1S)-1-carboxy-3-(methylsulfanyl)propyl]amino}-3-oxopropanoyl)-4-nitro-N-(4-nitrophenyl)anilinium
Molecular Formula C25H29N4O10S2
Molecular Weight 609.65
CAS Registry Number 87498-80-4
SMILES O=C([N+](c1ccc([N+]([O-])=O)cc1)(c2ccc(cc2)[N+]([O-])=O)[C@H](C(=O)O)CCSC)CC(=O)N[C@H](C(=O)O)CCSC
InChI 1S/C25H28N4O10S2/c1-40-13-11-20(24(32)33)26-22(30)15-23(31)29(21(25(34)35)12-14-41-2,18-7-3-16(4-8-18)27(36)37)19-9-5-17(6-10-19)28(38)39/h3-10,20-21H,11-15H2,1-2H3,(H2-,26,30,32,33,34,35)/p+1/t20-,21-/m0/s1
InChIKey UBHTYWNJBMNVHI-SFTDATJTSA-O
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