Home Chemical Structure L-allo-Isoleucine

Chemical Structure of L-allo-Isoleucine (C6H13NO2)

Identification of L-allo-Isoleucine Chemical Compound

2D chemical structure image of L-allo-Isoleucine
Chemical Formula C6H13NO2
Molecular Weight 131.17292 g/mol
IUPAC Name (2S,3R)-2-amino-3-methylpentanoic acid
SMILES String CCC(C)C(N)C(O)=O
InChI InChI=1S/C6H13NO2/c1-3-4(2)5(7)6(8)9/h4-5H,3,7H2,1-2H3,(H,8,9)/t4-,5+/m1/s1
InChIKey AGPKZVBTJJNPAG-UHNVWZDZSA-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 L-allo-Isoleucine molecule contains a total of 21 bond(s). There are 8 non-H bond(s), 1 multiple bond(s), 3 rotatable bond(s), 1 double bond(s), 1 carboxylic acid(s) (aliphatic), 1 primary amine(s) (aliphatic) and 1 hydroxyl group(s).
Images of the chemical structure of L-allo-Isoleucine are given below:

2D chemical structure image of L-allo-Isoleucine
2-dimensional (2D) chemical structure image of L-allo-Isoleucine
3D chemical structure image of L-allo-Isoleucine
3-dimensional (3D) chemical structure image of L-allo-Isoleucine

The 2D chemical structure image of L-allo-Isoleucine is also called skeletal formula, which is the standard notation for organic molecules. The carbon atoms in the chemical structure of L-allo-Isoleucine 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 L-allo-Isoleucine 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 L-allo-Isoleucine.


An Interactive 3-dimensional (3D) Visualization of L-allo-Isoleucine

For a better understanding of the chemical structure, an interactive 3D visualization of L-allo-Isoleucine is provided here.

The L-allo-Isoleucine 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 L-allo-Isoleucine 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 L-allo-Isoleucine 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 a image file.


Additional Information for Identifying L-allo-Isoleucine Molecule

  • Other names (synonyms) or registry numbers of L-allo-Isoleucine

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

    • L-allo-Isoleucine
    • L-Alloisoleucine
    • 1509-34-8
    • (2S,3R)-2-amino-3-methylpentanoic acid
    • Alloisoleucine
    • Allo-Isoleucine
    • allo-L-Isoleucine
    • (3R)-LS-isoleucine
    • Isoleucine, allo-
    • Isoleucine, threo-
    • L-Isoleucine, allo-
    • L-Isoleucine, threo-
    • threo-L-Isoleucine
    • H-Allo-Ile-OH
    • Norvaline, 3-methyl-, threo-
    • L(+)-Alloisoleucine
    • L-Norvaline, 3-methyl-, threo-
    • L-Isoleucine, 3-methyl-, threo-
    • threo-3-methyl-L-Norvaline
    • alle
    • DL-Allo-isoleucine
    • MFCD00066446
    • Pentanoic acid, 2-amino-3-methyl-, (S-(R*,S*))-
    • DL-Alloisoleucine
    • a-ile
    • L-allo-2-Amino-3-methylpentanoic acid
    • Allo-DL-isoleucine
    • H-allo-lle-OH
    • Alloisoleucine, DL-
    • AmbotzHAA1515
    • (+)-L-allo isoleucine
    • 6RNR8XN7S2
    • HMDB00557
    • ANW-44507
    • (2S,3R)-2-amino-3-methylpentanoate
    • RTR-006177
    • CAS-1509-34-8
    • [S-(R*,S*)]-2-Amino-3-methylpentanoate
    • (2S,3R)-2-azanyl-3-methyl-pentanoic acid
    • 2-amino-3-methyl-[S-(R*,S*)]-Pentanoate
    • [S-(R*,S*)]-2-Amino-3-methylpentanoic acid
    • K-4796
    • 2-amino-3-methyl-[S-(R*,S*)]-Pentanoic acid
    • A809090
    • (2S,3R)-2-amino-3-methyl-pentanoic acid
    • (2S,3R)-2-amino-3-methyl-valeric acid
    • 3107-04-8
    • Allo-L-isoleucine
    • Allo-DL-isoleucine
    • Pentanoic acid, 2-amino-3-methyl-, (S-(R*,S*))-

L-allo-Isoleucine Identification Summary Frequently Asked Questions (FAQs)

  • What’s the chemical formula of L-allo-Isoleucine?

    C6H13NO2
  • How many atoms and what are the elements included the L-allo-Isoleucine molecule?

    22 atom(s) – 13 Hydrogen atom(s), 6 Carbon atom(s), 1 Nitrogen atom(s) and 2 Oxygen atom(s)
  • How many chemical bonds and what kind of bonds are included the L-allo-Isoleucine structure?

    21 bond(s) – 8 non-H bond(s), 1 multiple bond(s), 3 rotatable bond(s), 1 double bond(s), 1 carboxylic acid(s) (aliphatic), 1 primary amine(s) (aliphatic) and 1 hydroxyl group(s)
  • What’s the L-allo-Isoleucine’s molecular weight?

    131.17292 g/mol
  • What’s the SMILES code of L-allo-Isoleucine?

    CCC(C)C(N)C(O)=O
  • What’s the InChI string of L-allo-Isoleucine?

    InChI=1S/C6H13NO2/c1-3-4(2)5(7)6(8)9/h4-5H,3,7H2,1-2H3,(H,8,9)/t4-,5+/m1/s1
  • What’s the InChIKey code of L-allo-Isoleucine?

    AGPKZVBTJJNPAG-UHNVWZDZSA-N

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