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ChEBI
> Main
CHEBI:81002 - Glucosisymbrin
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ChEBI Ontology
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ChEBI Name
Glucosisymbrin
ChEBI ID
CHEBI:81002
Stars
This entity has been manually annotated by a third party.
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Formula
C10H19NO10S2
Net Charge
0
Average Mass
377.38900
Monoisotopic Mass
377.04504
InChI
InChI=1S/C10H19NO10S2/c1-
4(2-
12)
9(11-
21-
23(17,18)
19)
22-
10-
8(16)
7(15)
6(14)
5(3-
13)
20-
10/h4-
8,10,12-
16H,2-
3H2,1H3,(H,17,18,19)
/t4?,5-
,6-
,7+,8-
,10+/m1/s1
InChIKey
WMJAKSMGNADDKY-QTCACZPWSA-N
SMILES
CC(CO)C(S[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)=NOS(O)(=O)=O
Roles Classification
Biological Role
(s):
plant metabolite
Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
(via
glucosinolic acid
)
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
Glucosisymbrin (
CHEBI:81002
)
is a
glucosinolic acid (
CHEBI:79316
)
Synonym
Source
1-Methyl-2-hydroxyetyl glucosinolate
KEGG COMPOUND
Manual Xref
Database
C17275
KEGG COMPOUND
View more database links
Last Modified
07 March 2024