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ChEBI
> Main
CHEBI:81479 - N1,N5,N10-Triferuloyl spermidine
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ChEBI Ontology
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ChEBI Name
N1,N5,N10-Triferuloyl spermidine
ChEBI ID
CHEBI:81479
Stars
This entity has been manually annotated by a third party.
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Formula
C37H43N3O9
Net Charge
0
Average Mass
673.75200
Monoisotopic Mass
673.29993
InChI
InChI=1S/C37H43N3O9/c1-
47-
32-
23-
26(7-
13-
29(32)
41)
10-
16-
35(44)
38-
19-
4-
5-
21-
40(37(46)
18-
12-
28-
9-
15-
31(43)
34(25-
28)
49-
3)
22-
6-
20-
39-
36(45)
17-
11-
27-
8-
14-
30(42)
33(24-
27)
48-
2/h7-
18,23-
25,41-
43H,4-
6,19-
22H2,1-
3H3,(H,38,44)
(H,39,45)
/b16-
10+,17-
11+,18-
12+
InChIKey
KMJWIBDYGUTEFB-WLJYFSRTSA-N
SMILES
COc1cc(\C=C\C(=O)NCCCCN(CCCNC(=O)\C=C\c2ccc(O)c(OC)c2)C(=O)\C=C\c2ccc(O)c(OC)c2)ccc1O
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
N1,N5,N10-Triferuloyl spermidine (
CHEBI:81479
)
is a
hydroxycinnamic acid (
CHEBI:24689
)
Manual Xref
Database
C18071
KEGG COMPOUND
View more database links