DIL

D-ISOLEUCINE

Created: 1999-07-08
Last modified:  2023-11-03

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Chemical Details

Formal Charge0
Atom Count22
Chiral Atom Count2
Bond Count21
Aromatic Bond Count0
2D diagram of DIL

Chemical Component Summary

NameD-ISOLEUCINE
Systematic Name (OpenEye OEToolkits)(2R,3R)-2-amino-3-methyl-pentanoic acid
FormulaC6 H13 N O2
Molecular Weight131.173
TypeD-PEPTIDE LINKING

Chemical Descriptors

TypeProgram Version Descriptor
SMILESACDLabs10.04O=C(O)C(N)C(C)CC
SMILESCACTVS3.341CC[CH](C)[CH](N)C(O)=O
SMILESOpenEye OEToolkits1.5.0CCC(C)C(C(=O)O)N
Canonical SMILESCACTVS3.341 CC[C@@H](C)[C@@H](N)C(O)=O
Canonical SMILESOpenEye OEToolkits1.5.0 CC[C@@H](C)[C@H](C(=O)O)N
InChIInChI1.03 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
InChIKeyInChI1.03 AGPKZVBTJJNPAG-RFZPGFLSSA-N

Related Resource References

Resource NameReference
PubChem 76551, 6950183
ChEBI CHEBI:27730
CCDC/CSD POXGAL, DAILEU01, ZATLOZ
COD 2102122