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Methyl 11-([(ethoxycarbonyl)sulfanyl]methyl)-6-(methoxycarbonyl)-4,9,12-trioxo-3-oxa-5,10,13-triazapentadecan-15-oate
SpectraBase Compound ID 8Fhqg1OPVSy
InChI InChI=1S/C18H29N3O10S/c1-5-30-17(26)21-11(16(25)29-4)7-8-13(22)20-12(10-32-18(27)31-6-2)15(24)19-9-14(23)28-3/h11-12H,5-10H2,1-4H3,(H,19,24)(H,20,22)(H,21,26)
InChIKey DVISQVCEFCPODW-UHFFFAOYSA-N
Mol Weight 479.5 g/mol
Molecular Formula C18H29N3O10S
Exact Mass 479.157365 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2aAYqRZ6UC
Name Methyl 11-([(ethoxycarbonyl)sulfanyl]methyl)-6-(methoxycarbonyl)-4,9,12-trioxo-3-oxa-5,10,13-triazapentadecan-15-oate
Alternate Name(s) 2-(carbethoxyamino)-5-[[1-[(carbethoxythio)methyl]-2-keto-2-[(2-keto-2-methoxy-ethyl)amino]ethyl]amino]-5-keto-valeric acid methyl ester 2-(ethoxycarbonylamino)-5-[[3-(ethoxycarbonylthio)-1-[(2-methoxy-2-oxoethyl)amino]-1-oxopropan-2-yl]amino]-5-oxopentanoic acid methyl ester Glutamine, N2-carboxy-N-[1-[(carboxymethyl)carbamoyl]-2-mercaptoethyl]-, N2-ethyl dimethyl ester, ethyl carbamate (ester), L- Glutathione, N,S-bis(ethoxycarbonyl) deriv., dimethyl ester Methyl 2-(ethoxycarbonylamino)-5-[[1-(ethoxycarbonylsulfanylmethyl)-2-[(2-methoxy-2-oxo-ethyl)amino]-2-oxo-ethyl]amino]-5-oxo-pentanoate Methyl 2-(ethoxycarbonylamino)-5-[[3-ethoxycarbonylsulfanyl-1-[(2-methoxy-2-oxidanylidene-ethyl)amino]-1-oxidanylidene-propan-2-yl]amino]-5-oxidanylidene-pentanoate Methyl 2-(ethoxycarbonylamino)-5-[[3-ethoxycarbonylsulfanyl-1-[(2-methoxy-2-oxoethyl)amino]-1-oxopropan-2-yl]amino]-5-oxopentanoate
CAS Registry Number 21026-92-6
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Formula C18H29N3O10S
InChI InChI=1S/C18H29N3O10S/c1-5-30-17(26)21-11(16(25)29-4)7-8-13(22)20-12(10-32-18(27)31-6-2)15(24)19-9-14(23)28-3/h11-12H,5-10H2,1-4H3,(H,19,24)(H,20,22)(H,21,26)
InChIKey DVISQVCEFCPODW-UHFFFAOYSA-N
Molecular Weight 479.501 g/mol
SMILES N(C(C(NCC(OC)=O)=O)CSC(OCC)=O)C(CCC(NC(OCC)=O)C(OC)=O)=O
SPLASH splash10-03xr-0966200000-5b1c9e3ccb65e829987a
Source of Spectrum T-68-4091-0
Wiley ID 62212