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ChEBI
> Main
CHEBI:34542 - Argiotoxin 659
Main
ChEBI Ontology
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ChEBI Name
Argiotoxin 659
ChEBI ID
CHEBI:34542
Stars
This entity has been manually annotated by a third party.
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Formula
C31H53N11O5
Net Charge
0
Average Mass
659.824
Monoisotopic Mass
659.42311
InChI
InChI=1S/C31H53N11O5/c32-
22(8-
5-
16-
40-
31(34)
35)
29(46)
38-
17-
7-
14-
37-
13-
6-
12-
36-
11-
2-
1-
3-
15-
39-
30(47)
24(19-
26(33)
44)
42-
27(45)
18-
21-
20-
41-
23-
9-
4-
10-
25(43)
28(21)
23/h4,9-
10,20,22,24,36-
37,41,43H,1-
3,5-
8,11-
19,32H2,(H2,33,44)
(H,38,46)
(H,39,47)
(H,42,45)
(H4,34,35,40)
/t22-
,24-
/m0/s1
InChIKey
ONYMEUPDKAAGRV-UPVQGACJSA-N
SMILES
N[C@@H](CCCNC(N)=N)C(=O)NCCCNCCCNCCCCCNC(=O)[C@H](CC(N)=O)NC(=O)Cc1c[nH]c2cccc(O)c12
Roles Classification
Chemical Role
(s):
Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Br
o
nsted base).
(via
oxoacid
)
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
Argiotoxin 659 (
CHEBI:34542
)
is a
N
-acyl-amino acid (
CHEBI:51569
)
Synonyms
Sources
Argiopinin III
KEGG COMPOUND
Argiotoxin 659
KEGG COMPOUND
Manual Xref
Database
C13929
KEGG COMPOUND
View more database links
Registry Number
Type
Source
111944-83-3
CAS Registry Number
KEGG COMPOUND
Last Modified
28 July 2014