Structure & Deep Data of Guineensine (C24H33NO3)

Chemical Structure Description

A chemical structure of a molecule includes the arrangement of atoms and the chemical bonds that hold the atoms together. The guineensine molecule contains a total of 62 bond(s). There are 29 non-H bond(s), 10 multiple bond(s), 12 rotatable bond(s), 4 double bond(s), 6 aromatic bond(s), 1 five-membered ring(s), 1 six-membered ring(s), 1 nine-membered ring(s), 1 secondary amide(s) (aliphatic), and 2 ether(s) (aromatic). Images of the chemical structure of guineensine are given below:

The 2D chemical structure image of guineensine is also called skeletal formula, which is the standard notation for organic molecules. The carbon atoms in the chemical structure of guineensine 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 guineensine 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 guineensine. Download structure data file (SDF/MOL) file of this compound.

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Additional Information for Identifying Guineensine Molecule

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

  The SMILES string of guineensine is CC(C)CNC(=O)C=CC=CCCCCCCC=Cc2ccc1OCOc1c2, which can be can be imported by most molecule editors for conversion back into two-dimensional drawings or three-dimensional models of the guineensine.

• Structure Data File (SDF/MOL File) of guineensine

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

• Chemical formula of guineensine

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

• Molecular weight of guineensine

  The molecular weight of guineensine is available in molecular weight page of guineensine, 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 guineensine

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

  • 2,4,12-Tridecatrienamide, 13-(1,3-benzodioxol-5-yl)-N-(2-methylpropyl)-, (E,E,E)-
  • 2,4,12-Tridecatrienamide, 13-(1,3-benzodioxol-5-yl)-N-(2-methylpropyl)-, (2E,4E,12E)-
  • (2E,4E,12E)-13-(benzo[d][1,3]dioxol-5-yl)-N-isobutyltrideca-2,4,12-trienamide
  • (2E,4E,12E)-13-(1,3-benzodioxol-5-yl)-N-isobutyl-trideca-2,4,12-trienamide
  • HMS2268L12
  • (2E,4E,12E)-13-(1,3-benzodioxol-5-yl)-N-(2-methylpropyl)trideca-2,4,12-trienamide
  • Guineesine
  • 55038-30-7
  • guineensine

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Guineensine Identification Summary Frequently Asked Questions (FAQs)

What’s the chemical formula of guineensine?
C24H33NO3
How many atoms and what are the elements included the guineensine molecule?
61 atom(s) - 33 Hydrogen atom(s), 24 Carbon atom(s), 1 Nitrogen atom(s), and 3 Oxygen atom(s)
How many chemical bonds and what kind of bonds are included the guineensine structure?
62 bond(s) - 29 non-H bond(s), 10 multiple bond(s), 12 rotatable bond(s), 4 double bond(s), 6 aromatic bond(s), 1 five-membered ring(s), 1 six-membered ring(s), 1 nine-membered ring(s), 1 secondary amide(s) (aliphatic), and 2 ether(s) (aromatic)
What’s the guineensine’s molecular weight?
383.52372 g/mol
What’s the SMILES code of guineensine?
CC(C)CNC(=O)C=CC=CCCCCCCC=Cc2ccc1OCOc1c2
What’s the InChI string of guineensine?
InChI=1S/C24H33NO3/c1-20(2)18-25-24(26)14-12-10-8-6-4-3-5-7-9-11-13-21-15-16-22-23(17-21)28-19-27-22/h8,10-17,20H,3-7,9,18-19H2,1-2H3,(H,25,26)/b10-8+,13-11+,14-12+
What’s the InChIKey code of guineensine?
FPMPOFBEYSSYDQ-AUVZEZIHSA-N

42 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).