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:34253 - 2-(S-Glutathionyl)acetyl chloride
Main
ChEBI Ontology
Automatic Xrefs
Reactions
Pathways
Models
ChEBI Name
2-(S-Glutathionyl)acetyl chloride
ChEBI ID
CHEBI:34253
Stars
This entity has been manually annotated by a third party.
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
C12H18ClN3O7S
Net Charge
0
Average Mass
383.807
Monoisotopic Mass
383.05540
InChI
InChI=1S/C12H18ClN3O7S/c13-
8(17)
5-
24-
4-
7(11(21)
15-
3-
10(19)
20)
16-
9(18)
2-
1-
6(14)
12(22)
23/h6-
7H,1-
5,14H2,(H,15,21)
(H,16,18)
(H,19,20)
(H,22,23)
/t6-
,7-
/m0/s1
InChIKey
QUWRSBQWJGCKIV-BQBZGAKWSA-N
SMILES
N[C@@H](CCC(=O)N[C@@H](CSCC(Cl)=O)C(=O)NCC(O)=O)C(O)=O
Metabolite of Species
Details
Mus musculus
(NCBI:txid10090)
Source: BioModels - MODEL1507180067 See:
PubMed
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
)
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
2-(S-Glutathionyl)acetyl chloride (
CHEBI:34253
)
is a
peptide (
CHEBI:16670
)
Synonym
Source
2-(S-Glutathionyl)acetyl chloride
KEGG COMPOUND
Manual Xrefs
Databases
C14865
KEGG COMPOUND
HMDB0060342
HMDB
View more database links
Last Modified
27 January 2016