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O,N-Permethylated modified ac-ser-arg-his-pro
SpectraBase Compound ID 8mNP3Dm2JS6
InChI InChI=1S/C34H53N9O7/c1-22-17-23(2)37-34(36-22)38(4)15-11-13-26(41(7)31(46)29(20-49-9)40(6)24(3)44)30(45)42(8)28(18-25-19-35-21-39(25)5)32(47)43-16-12-14-27(43)33(48)50-10/h17,19,21,26-29H,11-16,18,20H2,1-10H3
InChIKey PCAAEWICAGFKQI-UHFFFAOYSA-N
Mol Weight 699.9 g/mol
Molecular Formula C34H53N9O7
Exact Mass 699.406795 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID F5dnSfT9cHN
Name O,N-Permethylated modified ac-ser-arg-his-pro
Alternate Name(s) Methyl 1-[2-[(2-[(2-[acetyl(methyl)amino]-3-methoxypropanoyl)(methyl)amino]-5-[(4,6-dimethyl-2-pyrimidinyl)(methyl)amino]pentanoyl)(methyl)amino]-3-(1-methyl-1H-imidazol-4-yl)propanoyl]-2-pyrrolidinec Methyl 1-[2-[(2-[(2-[acetyl(methyl)amino]-3-methoxypropanoyl)(methyl)amino]-5-[(4,6-dimethyl-2-pyrimidinyl)(methyl)amino]pentanoyl)(methyl)amino]-3-(1-methyl-1H-imidazol-5-yl)propanoyl]-2-pyrrolidinec Methyl 1-[2-[{2-[{2-[acetyl(methyl)amino]-3-methoxypropanoyl}(methyl)amino]-5-[(4,6-dimethyl-2-pyrimidinyl)(methyl)amino]pentanoyl}(methyl)amino]-3-(1-methyl-1H-imidazol-5-yl)propanoyl]-2-pyrrolidinecarboxylate Proline, N-[N-[N2,N5-dimethyl-N5-(4,6-dimethyl-2-pyrimidinyl)-N2-[3-methoxy-2-(N-methylacetamido)-1-oxopropyl]ornithinyl]-N,1-dimethylhistidyl]-, methyl ester
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Formula C34H53N9O7
InChI InChI=1S/C34H53N9O7/c1-22-17-23(2)37-34(36-22)38(4)15-11-13-26(41(7)31(46)29(20-49-9)40(6)24(3)44)30(45)42(8)28(18-25-19-35-21-39(25)5)32(47)43-16-12-14-27(43)33(48)50-10/h17,19,21,26-29H,11-16,18,20H2,1-10H3
InChIKey PCAAEWICAGFKQI-UHFFFAOYSA-N
Molecular Weight 699.854 g/mol
SMILES C(=O)(N(C(C(N(C(C(=O)N(C)C(Cc1[n](cnc1)C)C(=O)N1CCCC1C(=O)OC)CCCN(C)c1nc(cc(n1)C)C)C)=O)COC)C)C
SPLASH splash10-0f9l-5922110000-efc882f1320a454cda87
Wiley ID 1475929