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InChI=1S/CH4O/c1-2/h2H,1H3
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ChEBI
> Main
CHEBI:10322 - alpha-Obscurine
Main
ChEBI Ontology
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ChEBI Name
alpha-Obscurine
ChEBI ID
CHEBI:10322
Stars
This entity has been manually annotated by a third party.
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Formula
C17H26N2O
Net Charge
0
Average Mass
274.402
Monoisotopic Mass
274.20451
InChI
InChI=1S/C17H26N2O/c1-
11-
8-
12-
9-
15-
14(5-
6-
16(20)
18-
15)
17(10-
11)
13(12)
4-
3-
7-
19(17)
2/h11-
13H,3-
10H2,1-
2H3,(H,18,20)
/t11-
,12+,13-
,17-
/m1/s1
InChIKey
HXJHQEWSHQXRPH-IPJQOSJUSA-N
SMILES
C[C@@H]1C[C@H]2CC3=C(CCC(=O)N3)[C@@]3(C1)[C@@H]2CCCN3C
ChEBI Ontology
Outgoing
alpha-Obscurine (
CHEBI:10322
)
is a
sesquiterpenoid (
CHEBI:26658
)
Synonym
Source
alpha-Obscurine
KEGG COMPOUND
Manual Xrefs
Databases
C00001951
KNApSAcK
C09889
KEGG COMPOUND
View more database links
Registry Number
Type
Source
596-55-4
CAS Registry Number
KEGG COMPOUND
Last Modified
28 July 2014