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InChI=1S/CH4O/c1-2/h2H,1H3
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ChEBI
> Main
CHEBI:59138 - (8
S
)-cinchonan
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ChEBI Ontology
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ChEBI Name
(8
S
)-cinchonan
ChEBI ID
CHEBI:59138
ChEBI ASCII Name
(8S)-cinchonan
Definition
The (8
S
)-epimer of cinchonan.
Stars
This entity has been manually annotated by the ChEBI Team.
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Formula
C19H22N2
Net Charge
0
Average Mass
278.39140
Monoisotopic Mass
278.17830
InChI
InChI=1S/C19H22N2/c1-
2-
14-
13-
21-
10-
8-
15(14)
11-
17(21)
12-
16-
7-
9-
20-
19-
6-
4-
3-
5-
18(16)
19/h2-
7,9,14-
15,17H,1,8,10-
13H2/t14-
,15-
,17-
/m0/s1
InChIKey
UFJOYVQIDSNLHC-ZOBUZTSGSA-N
SMILES
[H][C@]1(C[C@@H]2CC[N@]1C[C@@H]2C=C)Cc1ccnc2ccccc12
ChEBI Ontology
Outgoing
(8
S
)-cinchonan (
CHEBI:59138
)
is a
(8ξ)-cinchonan (
CHEBI:59137
)
Incoming
cinchonidine (
CHEBI:3703
)
has parent hydride
(8
S
)-cinchonan (
CHEBI:59138
)
quinine (
CHEBI:15854
)
has parent hydride
(8
S
)-cinchonan (
CHEBI:59138
)
quinine(1+) (
CHEBI:137041
)
has parent hydride
(8
S
)-cinchonan (
CHEBI:59138
)
IUPAC Name
(8α)-cinchonan
Synonyms
Sources
(8
S
)-cinchonan
ChEBI
4-((1
S
,2
S
,4
S
,5
R
)-5-vinyl-1-azabicyclo[2.2.2]oct-2-ylmethyl)quinoline
ChEBI
Registry Number
Type
Source
88419
Beilstein Registry Number
Beilstein
Last Modified
30 March 2010