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Structure & Deep Data of Z-GLU(OME)-OSU (C18H20N2O8)

Identification of Z-GLU(OME)-OSU Chemical Compound

2D chemical structure image of Z-GLU(OME)-OSU
Chemical Formula C18H20N2O8
Molecular Weight 392.36 g/mol
IUPAC Name 2,5-dioxopyrrolidin-1-yl 1-methyl (4S)-4-{[(benzyloxy)carbonyl]amino}pentanedioate
SMILES String COC(=O)CCC(NC(=O)OCc1ccccc1)C(=O)ON2C(=O)CCC2=O
InChI InChI=1S/C18H20N2O8/c1-26-16(23)10-7-13(17(24)28-20-14(21)8-9-15(20)22)19-18(25)27-11-12-5-3-2-4-6-12/h2-6,13H,7-11H2,1H3,(H,19,25)/t13-/m0/s1
InChIKey MZXKKWKDZNDBAG-ZDUSSCGKSA-N

Chemical Structure Description

A chemical structure of a molecule includes the arrangement of atoms and the chemical bonds that hold the atoms together. The Z-GLU(OME)-OSU molecule contains a total of 49 bond(s). There are 29 non-H bond(s), 11 multiple bond(s), 11 rotatable bond(s), 5 double bond(s), 6 aromatic bond(s), 1 five-membered ring(s), 1 six-membered ring(s), 1 ester(s) (aliphatic), 1 (thio-) carbamate(s) (aliphatic), and 1 hydroxylamine(s) (aliphatic). Images of the chemical structure of Z-GLU(OME)-OSU are given below:

2D chemical structure image of Z-GLU(OME)-OSU
2-dimensional (2D) chemical structure image of Z-GLU(OME)-OSU
3D chemical structure image of Z-GLU(OME)-OSU
3-dimensional (3D) chemical structure image of Z-GLU(OME)-OSU

The 2D chemical structure image of Z-GLU(OME)-OSU is also called skeletal formula, which is the standard notation for organic molecules. The carbon atoms in the chemical structure of Z-GLU(OME)-OSU are implied to be located at the corner(s) and hydrogen atoms attached to carbon atoms are not indicated – each carbon atom is considered to be associated with enough hydrogen atoms to provide the carbon atom with four bonds.

The 3D chemical structure image of Z-GLU(OME)-OSU is based on the ball-and-stick model which displays both the three-dimensional position of the atoms and the bonds between them. The radius of the spheres is therefore smaller than the rod lengths in order to provide a clearer view of the atoms and bonds throughout the chemical structure model of Z-GLU(OME)-OSU. Download structure data file (SDF/MOL) file of this compound.


Interactive 3D Visualization

For a better understanding of the chemical structure, an interactive 3D visualization of Z-GLU(OME)-OSU is provided here.

The Z-GLU(OME)-OSU molecule shown in the visualization screen can be rotated interactively by keep clicking and moving the mouse button. Mouse wheel zoom is available as well – the size of the Z-GLU(OME)-OSU molecule can be increased or decreased by scrolling the mouse wheel.

The information of the atoms, bonds, connectivity and coordinates included in the chemical structure of Z-GLU(OME)-OSU can easily be identified by this visualization. By right-clicking the visualization screen, various other options are available including the visualization of van der Waals surface and exporting to an image file.


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Additional Information for Identifying Z-GLU(OME)-OSU Molecule

  • SMILES (Simplified Molecular-Input Line-Entry System) string of Z-GLU(OME)-OSU

    The SMILES string of Z-GLU(OME)-OSU is COC(=O)CCC(NC(=O)OCc1ccccc1)C(=O)ON2C(=O)CCC2=O, which can be can be imported by most molecule editors for conversion back into two-dimensional drawings or three-dimensional models of the Z-GLU(OME)-OSU.

  • Structure Data File (SDF/MOL File) of Z-GLU(OME)-OSU

    The structure data file (SDF/MOL File) of Z-GLU(OME)-OSU is available for download in the SDF page of Z-GLU(OME)-OSU, which provides the information about the atoms, bonds, connectivity and coordinates of Z-GLU(OME)-OSU. The Z-GLU(OME)-OSU structure data file can be imported to most of the cheminformatics software systems and applications.

  • Chemical formula of Z-GLU(OME)-OSU

    The molecular formula of Z-GLU(OME)-OSU is available in chemical formula page of Z-GLU(OME)-OSU, which identifies each constituent element by its chemical symbol and indicates the proportionate number of atoms of each element.

  • Molecular weight of Z-GLU(OME)-OSU

    The molecular weight of Z-GLU(OME)-OSU is available in molecular weight page of Z-GLU(OME)-OSU, which is calculated as the sum of the atomic weights of each constituent element multiplied by the number of atoms of that element in the molecular formula.

  • Other names (synonyms) or registry numbers of Z-GLU(OME)-OSU

    The Z-GLU(OME)-OSU compound may be called differently depending on the various different situations of industrial applications. Below are the list of the other names (synonyms) of Z-GLU(OME)-OSU including the various registry numbers, if available:

    • (S)-5-[(2,5-Dioxo-1-pyrrolidinyl)oxy]-5-oxo-4-[[(benzyloxy)carbonyl]amino]valeric acid methyl ester
    • (S)-1-(2,5-Dioxopyrrolidin-1-yl) 5-methyl 2-(((benzyloxy)carbonyl)amino)pentanedioate
    • K-8497
    • MFCD00191088
    • 7904AH
    • C18H20N2O8
    • 39538-31-3
    • Z-GLU(OME)-OSU

Z-GLU(OME)-OSU Identification Summary Frequently Asked Questions (FAQs)

What’s the chemical formula of Z-GLU(OME)-OSU?
C18H20N2O8
How many atoms and what are the elements included the Z-GLU(OME)-OSU molecule?
48 atom(s) - 20 Hydrogen atom(s), 18 Carbon atom(s), 2 Nitrogen atom(s), and 8 Oxygen atom(s)
How many chemical bonds and what kind of bonds are included the Z-GLU(OME)-OSU structure?
49 bond(s) - 29 non-H bond(s), 11 multiple bond(s), 11 rotatable bond(s), 5 double bond(s), 6 aromatic bond(s), 1 five-membered ring(s), 1 six-membered ring(s), 1 ester(s) (aliphatic), 1 (thio-) carbamate(s) (aliphatic), and 1 hydroxylamine(s) (aliphatic)
What’s the Z-GLU(OME)-OSU’s molecular weight?
392.36 g/mol
What’s the SMILES code of Z-GLU(OME)-OSU?
COC(=O)CCC(NC(=O)OCc1ccccc1)C(=O)ON2C(=O)CCC2=O
What’s the InChI string of Z-GLU(OME)-OSU?
InChI=1S/C18H20N2O8/c1-26-16(23)10-7-13(17(24)28-20-14(21)8-9-15(20)22)19-18(25)27-11-12-5-3-2-4-6-12/h2-6,13H,7-11H2,1H3,(H,19,25)/t13-/m0/s1
What’s the InChIKey code of Z-GLU(OME)-OSU?
MZXKKWKDZNDBAG-ZDUSSCGKSA-N

31 The contents of this page can freely be shared if cited as follows:
Source: Chemical Compounds Deep Data Source (CCDDS; https://www.molinstincts.com) based on 41 patented QSQN and QN technology
commercialized into Mol-Instincts database and ChemRTP, ChemEssen, Inc (2024).

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