Home Structure This Compound
loading

Structure & Deep Data of Neuropeptide DF2 (C44H67N15O10)

Identification of Neuropeptide DF2 Chemical Compound

2D chemical structure image of Neuropeptide DF2
Chemical Formula C44H67N15O10
Molecular Weight 966.09728 g/mol
IUPAC Name (3S)-3-amino-3-{[(1S)-1-{[(1S)-2-carbamoyl-1-{[(1S)-1-{[(1S)-1-{[(1S)-1-{[(1S)-1-carbamoyl-2-phenylethyl]carbamoyl}-4-[(diaminomethylidene)amino]butyl]carbamoyl}-3-methylbutyl]carbamoyl}-2-phenylethyl]carbamoyl}ethyl]carbamoyl}-4-[(diaminomethylidene)amino]butyl]carbamoyl}propanoic acid
SMILES String CC(C)CC(NC(=O)C(Cc1ccccc1)NC(=O)C(CC(N)=O)NC(=O)C(CCCN=C(N)N)NC(=O)C(N)CC(O)=O)C(=O)NC(CCCN=C(N)N)C(=O)NC(Cc2ccccc2)C(N)=O
InChI InChI=1S/C44H67N15O10/c1-24(2)19-31(40(67)55-29(16-10-18-53-44(50)51)38(65)56-30(36(47)63)20-25-11-5-3-6-12-25)57-41(68)32(21-26-13-7-4-8-14-26)58-42(69)33(23-34(46)60)59-39(66)28(15-9-17-52-43(48)49)54-37(64)27(45)22-35(61)62/h3-8,11-14,24,27-33H,9-10,15-23,45H2,1-2H3,(H2,46,60)(H2,47,63)(H,54,64)(H,55,67)(H,56,65)(H,57,68)(H,58,69)(H,59,66)(H,61,62)(H4,48,49,52)(H4,50,51,53)/t27-,28-,29-,30-,31-,32-,33-/m0/s1
InChIKey DWSQPUHNGRSXSJ-MRNVWEPHSA-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 Neuropeptide DF2 molecule contains a total of 137 bond(s). There are 70 non-H bond(s), 23 multiple bond(s), 31 rotatable bond(s), 11 double bond(s), 12 aromatic bond(s), 2 six-membered ring(s), 1 carboxylic acid(s) (aliphatic), 2 primary amide(s) (aliphatic), 6 secondary amide(s) (aliphatic), 2 guanidine derivative(s), 5 primary amine(s) (aliphatic), and 1 hydroxyl group(s). Images of the chemical structure of Neuropeptide DF2 are given below:

2D chemical structure image of Neuropeptide DF2
2-dimensional (2D) chemical structure image of Neuropeptide DF2
3D chemical structure image of Neuropeptide DF2
3-dimensional (3D) chemical structure image of Neuropeptide DF2

The 2D chemical structure image of Neuropeptide DF2 is also called skeletal formula, which is the standard notation for organic molecules. The carbon atoms in the chemical structure of Neuropeptide DF2 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 Neuropeptide DF2 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 Neuropeptide DF2. 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 Neuropeptide DF2 is provided here.

The Neuropeptide DF2 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 Neuropeptide DF2 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 Neuropeptide DF2 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.


Search Another Chemical Structure

Enter another compound to search for chemical structure:

Input a chemical compound consisting of C, H, N, O, S, F, Cl, Br, I, Si, P, and/or As atom(s)

Input example for Ethanol:

  • Name: ethanol
  • CAS #: 64-17-5
  • Formula: C2H5OH
  • Smiles: CCO
  • InChI: InChI=1S/C2H6O/c1-2-3/h3H,2H2,1H3
  • InChIKey: LFQSCWFLJHTTHZ-UHFFFAOYSA-N

Deep Data Application Examples

Our Deep Data encompasses property data, spectral data, quantum chemical data, and molecular descriptor data for a wide range of chemical compounds. It features more than 2,100 high-quality datasets per single chemical compound, totaling over 8 billion datasets for 4.1+ million chemical compounds. Below are some application examples that may interest you:

Additional Information for Identifying Neuropeptide DF2 Molecule

  • SMILES (Simplified Molecular-Input Line-Entry System) string of Neuropeptide DF2

    The SMILES string of Neuropeptide DF2 is CC(C)CC(NC(=O)C(Cc1ccccc1)NC(=O)C(CC(N)=O)NC(=O)C(CCCN=C(N)N)NC(=O)C(N)CC(O)=O)C(=O)NC(CCCN=C(N)N)C(=O)NC(Cc2ccccc2)C(N)=O, which can be can be imported by most molecule editors for conversion back into two-dimensional drawings or three-dimensional models of the Neuropeptide DF2.

  • Structure Data File (SDF/MOL File) of Neuropeptide DF2

    The structure data file (SDF/MOL File) of Neuropeptide DF2 is available for download in the SDF page of Neuropeptide DF2, which provides the information about the atoms, bonds, connectivity and coordinates of Neuropeptide DF2. The Neuropeptide DF2 structure data file can be imported to most of the cheminformatics software systems and applications.

  • Chemical formula of Neuropeptide DF2

    The molecular formula of Neuropeptide DF2 is available in chemical formula page of Neuropeptide DF2, which identifies each constituent element by its chemical symbol and indicates the proportionate number of atoms of each element.

  • Molecular weight of Neuropeptide DF2

    The molecular weight of Neuropeptide DF2 is available in molecular weight page of Neuropeptide DF2, 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 Neuropeptide DF2

    The Neuropeptide DF2 compound may be called differently depending on the various different situations of industrial applications. Below are the list of the other names (synonyms) of Neuropeptide DF2 including the various registry numbers, if available:

    • L-Phenylalaninamide, L-alpha-aspartyl-L-arginyl-L-asparaginyl-L-phenylalanyl-L-leucyl-L-arginyl-
    • (3S)-3-amino-4-[[(2S)-1-[[(2S)-4-amino-1-[[(2S)-1-[[(2S)-1-[[(2S)-1-[[(2S)-1-amino-1-oxo-3-phenylpropan-2-yl]amino]-5-(diaminomethylideneamino)-1-oxopentan-2-yl]amino]-4-methyl-1-oxopentan-2-yl]amino]-1-oxo-3-phenylpropan-2-yl]amino]-1,4-dioxobutan-2-yl]amino]-5-(diaminomethylideneamino)-1-oxopentan-2-yl]amino]-4-oxobutanoic acid
    • L-alpha-Aspartyl-L-arginyl-L-asparaginyl-L-phenylalanyl-L-leucyl-L-arginyl-L-phenylalaninamide
    • Aspartyl-arginyl-asparaginyl-phenylalanyl-leucyl-arginyl-phenylalaninamide
    • Mar-FLP1
    • Asp-arg-asn-phe-leu-arg-phe-NH2
    • DF(2) Neuropeptide
    • Drnflrfamide
    • 149471-11-4
    • Neuropeptide DF2

Neuropeptide DF2 Identification Summary Frequently Asked Questions (FAQs)

What’s the chemical formula of Neuropeptide DF2?
C44H67N15O10
How many atoms and what are the elements included the Neuropeptide DF2 molecule?
136 atom(s) - 67 Hydrogen atom(s), 44 Carbon atom(s), 15 Nitrogen atom(s), and 10 Oxygen atom(s)
How many chemical bonds and what kind of bonds are included the Neuropeptide DF2 structure?
137 bond(s) - 70 non-H bond(s), 23 multiple bond(s), 31 rotatable bond(s), 11 double bond(s), 12 aromatic bond(s), 2 six-membered ring(s), 1 carboxylic acid(s) (aliphatic), 2 primary amide(s) (aliphatic), 6 secondary amide(s) (aliphatic), 2 guanidine derivative(s), 5 primary amine(s) (aliphatic), and 1 hydroxyl group(s)
What’s the Neuropeptide DF2’s molecular weight?
966.09728 g/mol
What’s the SMILES code of Neuropeptide DF2?
CC(C)CC(NC(=O)C(Cc1ccccc1)NC(=O)C(CC(N)=O)NC(=O)C(CCCN=C(N)N)NC(=O)C(N)CC(O)=O)C(=O)NC(CCCN=C(N)N)C(=O)NC(Cc2ccccc2)C(N)=O
What’s the InChI string of Neuropeptide DF2?
InChI=1S/C44H67N15O10/c1-24(2)19-31(40(67)55-29(16-10-18-53-44(50)51)38(65)56-30(36(47)63)20-25-11-5-3-6-12-25)57-41(68)32(21-26-13-7-4-8-14-26)58-42(69)33(23-34(46)60)59-39(66)28(15-9-17-52-43(48)49)54-37(64)27(45)22-35(61)62/h3-8,11-14,24,27-33H,9-10,15-23,45H2,1-2H3,(H2,46,60)(H2,47,63)(H,54,64)(H,55,67)(H,56,65)(H,57,68)(H,58,69)(H,59,66)(H,61,62)(H4,48,49,52)(H4,50,51,53)/t27-,28-,29-,30-,31-,32-,33-/m0/s1
What’s the InChIKey code of Neuropeptide DF2?
DWSQPUHNGRSXSJ-MRNVWEPHSA-N

17 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).

Subscribe to our newsletter

Join our subscribers list to get the latest news, updates and special offers delivered directly in your inbox.