Services
Research
Training
Industry
About us
ChEBI
Examples:
iron*
,
InChI=1S/CH4O/c1-2/h2H,1H3
,
caffeine
Advanced
Home
Advanced Search
Browse
Documentation
Download
Tools
About ChEBI
Submit
Contact us
DiNA
Statistics
Entity of the Month
Periodic Table
Ontology
Train online
User Manual
Annotation Manual
Developer Manual
FAQ's
BiNChE
libChEBI
Web Services
ChEBI
> Main
CHEBI:73805 - Ala-Ile
Main
ChEBI Ontology
Automatic Xrefs
Reactions
Pathways
Models
ChEBI Name
Ala-Ile
ChEBI ID
CHEBI:73805
Definition
A dipeptide formed from
L
-alanyl and
L
-isoleucine residues.
Stars
This entity has been manually annotated by the ChEBI Team.
Supplier Information
Download
Molfile
XML
SDF
Find compounds which contain this structure
Find compounds which resemble this structure
Take structure to the Advanced Search
Formula
C9H18N2O3
Net Charge
0
Average Mass
202.25080
Monoisotopic Mass
202.13174
InChI
InChI=1S/C9H18N2O3/c1-
4-
5(2)
7(9(13)
14)
11-
8(12)
6(3)
10/h5-
7H,4,10H2,1-
3H3,(H,11,12)
(H,13,14)
/t5-
,6-
,7-
/m0/s1
InChIKey
ZSOICJZJSRWNHX-ACZMJKKPSA-N
SMILES
CC[C@H](C)[C@H](NC(=O)[C@H](C)N)C(O)=O
Roles Classification
Chemical Role
(s):
Bronsted base
A molecular entity capable of accepting a hydron from a donor (Br
o
nsted acid).
(via
organic amino compound
)
Biological Role
(s):
metabolite
Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
Ala-Ile (
CHEBI:73805
)
has role
metabolite (
CHEBI:25212
)
Ala-Ile (
CHEBI:73805
)
is a
dipeptide (
CHEBI:46761
)
IUPAC Name
L
-alanyl-
L
-isoleucine
Synonyms
Sources
AI
ChEBI
alanylisoleucine
ChEBI
L
-Ala-
L
-Ile
ChEBI
Manual Xref
Database
HMDB0028690
HMDB
View more database links
Registry Number
Type
Source
3606306
Reaxys Registry Number
Reaxys
Last Modified
23 October 2015