Isoleucine (data page)

OrganicBox complete
wiki_name=Isoleucine
name=(2"S",3"S")-2-amino-3-methylpentanoic acid
= GENERAL INFORMATION =

C=6 | H=13 | N=1 | O=2
mass=131.18 ref_N|1|a
abbreviation=I, Ile


synonyms={2/α}-amino-{3/β}-methylvaleric acid
3-methyl-{/erythro-}norvaline
Amino-sec-butyl-acetic acid
Amino(1-methylpropyl)-acetic acid
= DATABASES =

SMILES=CC [C@H] (C) [C@@H] (C(=O)O)N ref_N|1|b
InChI=1/C6H13NO2/c1-3-4(2)5(7)6(8)9/h4-5H,3,7H2,1-2H3,(H,8,9)/t4-,5-/m0/s1/f/h8H ref_N|1|c
ATC_prefix=
ATC_suffix=
ATC_supplemental=
CAS=73-32-5
DrugBank=
EINECS=200-798-2 ref_N|1|d
PubChem=6306
= PHYSICAL PROPERTIES =

--------------- Structure -------------
index_of_refraction=
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------------- Spectrometry data --------------
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-------- Phase behaviour -------
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------- Solid properties -------
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melting_point_C=284
melting_point_F=
melting_point_K=
------- Liquid properties -------
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------------- Gas properties --------------
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= HAZARD PROPERTIES =

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= CHEMICAL PROPERTIES =

XLogP=-1.743 ref_N|1|e
isoelectric_point=6.02
disociation_constant=2.26; 9.60
tautomers=
H_bond_donor=2 ref_N|1|f
H_bond_acceptor=3 ref_N|1|g
= PHARMACOLOGICAL PROPERTIES =

bioavailability=
metabolism=
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References

#note_N|1|a note_N|1|b note_N|1|c note_N|1|d note_N|1|e note_N|1|f note_N|1|g PubChem|6306