Services
Research
Training
Industry
About us
ChEBI
Examples:
iron*
,
InChI=1S/CH4O/c1-2/h2H,1H3
,
caffeine
Advanced
Home
Advanced Search
Browse
Documentation
Download
Tools
About ChEBI
Submit
Contact us
DiNA
Statistics
Entity of the Month
Periodic Table
Ontology
Train online
User Manual
Annotation Manual
Developer Manual
FAQ's
BiNChE
libChEBI
Web Services
ChEBI
> Main
CHEBI:138030 -
N
-caffeoylspermidine
Main
ChEBI Ontology
Automatic Xrefs
Reactions
Pathways
Models
ChEBI Name
N
-caffeoylspermidine
ChEBI ID
CHEBI:138030
ChEBI ASCII Name
N-caffeoylspermidine
Stars
This entity has been manually annotated by a third party.
Supplier Information
Download
Molfile
XML
SDF
Find compounds which contain this structure
Find compounds which resemble this structure
Take structure to the Advanced Search
Formula
C16H25N3O3
Net Charge
0
Average Mass
307.389
Monoisotopic Mass
307.18959
InChI
InChI=1S/C16H25N3O3/c17-
8-
1-
2-
9-
18-
10-
3-
11-
19-
16(22)
7-
5-
13-
4-
6-
14(20)
15(21)
12-
13/h4-
7,12,18,20-
21H,1-
3,8-
11,17H2,(H,19,22)
/b7-
5+
InChIKey
AZSUJBAOTYNFDE-FNORWQNLSA-N
SMILES
C=1(C=C(C(=CC1)O)O)/C=C/C(NCCCNCCCCN)=O
ChEBI Ontology
Outgoing
N
-caffeoylspermidine (
CHEBI:138030
)
has functional parent
trans
-caffeic acid (
CHEBI:16433
)
N
-caffeoylspermidine (
CHEBI:138030
)
has functional parent
spermidine (
CHEBI:16610
)
N
-caffeoylspermidine (
CHEBI:138030
)
is a
catechols (
CHEBI:33566
)
N
-caffeoylspermidine (
CHEBI:138030
)
is a
secondary carboxamide (
CHEBI:140325
)
Last Modified
27 July 2017