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ChEBI
> Main
CHEBI:9717 - Triglochinin
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ChEBI Ontology
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ChEBI Name
Triglochinin
ChEBI ID
CHEBI:9717
Stars
This entity has been manually annotated by a third party.
Supplier Information
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Formula
C14H17NO10
Net Charge
0
Average Mass
359.286
Monoisotopic Mass
359.08525
InChI
InChI=1S/C14H17NO10/c15-
4-
7(6(3-
10(19)
20)
1-
2-
9(17)
18)
24-
14-
13(23)
12(22)
11(21)
8(5-
16)
25-
14/h1-
2,8,11-
14,16,21-
23H,3,5H2,(H,17,18)
(H,19,20)
/b2-
1-
,7-
6-
/t8-
,11-
,12+,13-
,14-
/m1/s1
InChIKey
LABCALMTQNDOAI-PKNBYVPASA-N
SMILES
OC[C@H]1O[C@@H](O\C(C#N)=C(CC(O)=O)\C=C/C(O)=O)[C@H](O)[C@@H](O)[C@@H]1O
Roles Classification
Biological Role
(s):
metabolite
Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
(via
cyanogenic glycoside
)
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
Triglochinin (
CHEBI:9717
)
is a
cyanogenic glycoside (
CHEBI:23436
)
Synonyms
Sources
2-Hexenedioic acid,4-(cyano(beta-D-glucopyranosyloxy)methylene)-, (E,Z)-
KEGG COMPOUND
Triglochinin
KEGG COMPOUND
Manual Xrefs
Databases
C00001457
KNApSAcK
C08342
KEGG COMPOUND
View more database links
Registry Number
Type
Source
28876-11-1
CAS Registry Number
KEGG COMPOUND
Last Modified
28 July 2014