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InChI=1S/CH4O/c1-2/h2H,1H3
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ChEBI
> Main
CHEBI:3447 - Caseadine
Main
ChEBI Ontology
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ChEBI Name
Caseadine
ChEBI ID
CHEBI:3447
Stars
This entity has been manually annotated by a third party.
Supplier Information
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Formula
C20H23NO4
Net Charge
0
Average Mass
341.402
Monoisotopic Mass
341.16271
InChI
InChI=1S/C20H23NO4/c1-
23-
16-
5-
4-
12-
6-
7-
21-
11-
14-
10-
18(25-
3)
17(24-
2)
9-
13(14)
8-
15(21)
19(12)
20(16)
22/h4-
5,9-
10,15,22H,6-
8,11H2,1-
3H3/t15-
/m0/s1
InChIKey
HXHKKYNHNQVAAX-HNNXBMFYSA-N
SMILES
COc1ccc2CCN3Cc4cc(OC)c(OC)cc4C[C@H]3c2c1O
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
alkaloid
)
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
Caseadine (
CHEBI:3447
)
is a
alkaloid (
CHEBI:22315
)
Synonym
Source
Caseadine
KEGG COMPOUND
Manual Xrefs
Databases
C00001832
KNApSAcK
C09377
KEGG COMPOUND
View more database links
Registry Number
Type
Source
34413-12-2
CAS Registry Number
KEGG COMPOUND
Last Modified
28 July 2014