Methyl (3S)-3-[(cyclohexylcarbamoyl)amino]-1-[(1-methyl-1H-pyrrol-2-yl)carbonyl]-L-prolyl-D-prolinate

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Systematic / IUPAC Name: Methyl (2R)-1-[(2S,3S)-3-(cyclohexylcarbamoylamino)-1-(1-methylpyrrole-2-carbonyl)pyrrolidine-2-carbonyl]pyrrolidine-2-carboxylate

ID: Reference13074

Other Names: D-Proline, (3S)-3-[[(cyclohexylamino)carbonyl]amino]-1-[(1-methyl-1H-pyrrol-2-yl)carbonyl]-L-prolyl-, methyl ester;
NAT3-177842

Formula: C24H35N5O5

Spectral Data

Methyl (3S)-3-[(cyclohexylcarbamoyl)amino]-1-[(1-methyl-1H-pyrrol-2-yl)carbonyl]-L-prolyl-D-prolinate mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.

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Available MS Data

Used Instruments Orbitrap Fusion Lumos with ETD LBP
No. of Spectral Trees 1
No. of Spectra 2320
Tandem Spectra MS1, MS2, MS3, MS4
Ionization Methods NSI
Analyzers FT
Last Modification 3/22/2024 3:03:54 PM
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Identificators

InChI InChI=1S/C24H35N5O5/c1-27-13-6-10-18(27)21(30)29-15-12-17(26-24(33)25-16-8-4-3-5-9-16)20(29)22(31)28-14-7-11-19(28)23(32)34-2/h6,10,13,16-17,19-20H,3-5,7-9,11-12,14-15H2,1-2H3,(H2,25,26,33)/t17-,19+,20-/m0/s1
InChI Key VIXAPHJTGWMDNR-SXLOBPIMSA-N
Canonical SMILES CN1C=CC=C1C(=O)N2CCC(C2C(=O)N3CCCC3C(=O)OC)NC(=O)NC4CCCCC4
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Other Names D-Proline, (3S)-3-[[(cyclohexylamino)carbonyl]amino]-1-[(1-methyl-1H-pyrrol-2-yl)carbonyl]-L-prolyl-, methyl ester;
NAT3-177842

In Other Databases

PubChem 11865813
ChemSpider 10040146