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CHEBI:68032 - Eusynstyelamide D
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ChEBI Name
Eusynstyelamide D
ChEBI ID
CHEBI:68032
Definition
A natural product found in
Tegella cf. spitzbergensis
.
Stars
This entity has been manually annotated by a third party.
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Formula
C30H36Br2N6O4
Net Charge
0
Average Mass
704.45300
Monoisotopic Mass
702.11648
InChI
InChI=1S/C30H36Br2N6O4/c31-
19-
5-
7-
21-
18(16-
36-
24(21)
13-
19)
15-
29(41)
26(23-
17-
37-
25-
14-
20(32)
6-
8-
22(23)
25)
30(42,27(39)
35-
11-
3-
1-
9-
33)
38(28(29)
40)
12-
4-
2-
10-
34/h5-
8,13-
14,16-
17,26,36-
37,41-
42H,1-
4,9-
12,15,33-
34H2,(H,35,39)
/t26-
,29+,30+/m1/s1
InChIKey
PIHIJDUVKHNVTR-POLDFPFKSA-N
SMILES
NCCCCNC(=O)[C@@]1(O)[C@H](c2c[nH]c3cc(Br)ccc23)[C@@](O)(Cc2c[nH]c3cc(Br)ccc23)C(=O)N1CCCCN
Metabolite of Species
Details
Tegella cf.
sp.
tzbergensis
(NCBI:txid546940)
Lyophilized material of the bryozoan was extracted with CH2Cl2/MeOH (1:1) See:
PubMed
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.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
Eusynstyelamide D (
CHEBI:68032
)
has role
metabolite (
CHEBI:25212
)
Eusynstyelamide D (
CHEBI:68032
)
is a
amino acid amide (
CHEBI:22475
)
Synonym
Source
(2S,3R,4S)-
N,1-
bis(4-
aminobutyl)-
3-
(6-
bromo-
1H-
indol-
3-
yl)-
4-
[(6-
bromo-
1H-
indol-
3-
yl)methyl]-
2,4-
dihydroxy-
5-
oxopyrrolidine-
2-
carboxamide
ChEBI
Citation
Type
Source
21370896
PubMed citation
Europe PMC
Last Modified
22 September 2014
General Comment
2014-10-17
Suggested Classification: ISA:indoles(CHEBI:24828); ISA:pyrrolidinecarboxamide(CHEBI:46770); ISA:organobromine compound(CHEBI:37141); ISA:aralkylamine(CHEBI:18000); ISA:pyrroles(CHEBI:26455); ISA:pyrrolidine-2-ones(CHEBI:74223); ISA:N-alkylpyrrolidine(CHEBI:46775); ISA:tertiary alcohol(CHEBI:26878); ISA:carboxamide(CHEBI:37622); ISA:tertiary amine(CHEBI:32876); ISA:lactam(CHEBI:24995); ISA:organonitrogen compound(CHEBI:35352); ISA:carboxylic acid(CHEBI:33575); ISA:amino alcohol(CHEBI:22478); ISA:carbonyl compound(CHEBI:36586); ISA:alkylamine(CHEBI:13759);