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H-Gly-Ile-OH

CAT: 0121-4000546.0005Size: 5 gDry Ice: NoHazardous: No
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CAT#:0121-4000546.0005Size:5 g
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CAS Number
19461-38-2
Specifications
G-2135.0005
Sequence
H-Gly-Ile-OH
Molecular Formula
C₈H₁₆N₂O₃
Molecular Weight
188.23
Shipping Conditions
Ambient Temperature
Storage Temperature
< -15°C

Chemical Information

glycyl-L-isoleucine

Gly-Ile is a dipeptide formed from glycine and L-isoleucine residues. It has a role as a metabolite.

CAS Number19461-38-2
PubChem CID88079
IUPAC Name(2S,3S)-2-[(2-aminoacetyl)amino]-3-methylpentanoic acid
Molecular FormulaC8H16N2O3
Molecular Weight188.22
XLogP-3
Topological Polar Surface Area92.4
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count4
Rotatable Bond Count5
Heavy Atom Count13
Formal Charge0
Complexity194
SMILES
CC[C@H](C)[C@@H](C(=O)O)NC(=O)CN
InChI
InChI=1S/C8H16N2O3/c1-3-5(2)7(8(12)13)10-6(11)4-9/h5,7H,3-4,9H2,1-2H3,(H,10,11)(H,12,13)/t5-,7-/m0/s1
InChIKey
KGVHCTWYMPWEGN-FSPLSTOPSA-N
Chemical Structure
2D Structure
2D structure of glycyl-L-isoleucine
CAS: 19461-38-2
CID: 88079
Formula: C8H16N2O3
MW: 188.22
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight188.22
XLogP3-3
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count4
Rotatable Bond Count5
Exact Mass188.11609238
Monoisotopic Mass188.11609238
Topological Polar Surface Area92.4 Ų
Heavy Atom Count13
Formal Charge0
Complexity194
Isotope Atom Count0
Defined Atom Stereocenter Count2
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes