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InChI=1S/CH4O/c1-2/h2H,1H3
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CHEBI:89480 - Methyl bisnorbiotinyl ketone
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ChEBI Name
Methyl bisnorbiotinyl ketone
ChEBI ID
CHEBI:89480
Stars
This entity has been manually annotated by a third party.
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Formula
C9H14N2O2S
Net Charge
0
Average Mass
214.286
Monoisotopic Mass
214.07760
InChI
InChI=1S/C9H14N2O2S/c1-
5(12)
2-
3-
7-
8-
6(4-
14-
7)
10-
9(13)
11-
8/h6-
8H,2-
4H2,1H3,(H2,10,11,13)
/t6-
,7-
,8-
/m0/s1
InChIKey
ITHUGYGPPSVHRH-FXQIFTODSA-N
SMILES
C1(N[C@@]2([C@](N1)([C@@H](SC2)CCC(C)=O)[H])[H])=O
Metabolite of Species
Details
Homo sapiens
(NCBI:txid9606)
Found in urine
(BTO:0001419)
. See:
PubMed
ChEBI Ontology
Outgoing
Methyl bisnorbiotinyl ketone (
CHEBI:89480
)
is a
imidazolidinone (
CHEBI:55370
)
Synonyms
Sources
(3aS,4S,6aR)-4-(3-oxobutyl)-hexahydro-1H-thieno[3,4-d]imidazolidin-2-one
HMDB
[3aS-(3aa,4b,6aa)]-tetrahydro-4-(3-oxobutyl)-1H-Thieno[3,4-D]imidazol-2(3H)-one
HMDB
Manual Xref
Database
HMDB0004822
HMDB
View more database links
Registry Number
Type
Source
35638-35-8
CAS Registry Number
KEGG COMPOUND
Citations
Types
Sources
9022537
PubMed citation
Europe PMC
9039841
PubMed citation
Europe PMC