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> Main
CHEBI:69614 - Trichodepsipeptide B
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ChEBI Name
Trichodepsipeptide B
ChEBI ID
CHEBI:69614
Definition
A natural product found in
Trichothecium
species
MSX 51320
.
Stars
This entity has been manually annotated by a third party.
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Formula
C35H54N4O9
Net Charge
0
Average Mass
674.82470
Monoisotopic Mass
674.38908
InChI
InChI=1S/C35H54N4O9/c1-
19(2)
15-
26-
30(41)
38-
28(21(5)
6)
32(43)
37-
25(18-
40)
34(45)
48-
29(22(7)
8)
35(46)
47-
27(16-
20(3)
4)
31(42)
36-
24(33(44)
39(26)
9)
17-
23-
13-
11-
10-
12-
14-
23/h10-
14,19-
22,24-
29,40H,15-
18H2,1-
9H3,(H,36,42)
(H,37,43)
(H,38,41)
/t24-
,25-
,26-
,27-
,28-
,29-
/m0/s1
InChIKey
OFQBSWDOEHTKQI-AQRCPPRCSA-N
SMILES
CC(C)
C[C@@H]
1OC(=O)
[C@@H]
(OC(=O)
[C@H]
(CO)
NC(=O)
[C@@H]
(NC(=O)
[C@H]
(CC(C)
C)
N(C)
C(=O)
[C@H]
(Cc2ccccc2)
NC1=O)
C(C)
C)
C(C)
C
Metabolite of Species
Details
Trichothecium
sp.
cies MSX 51320
(NCBI:txid1094547)
Mycosynthetix fungal strain was isolated by Dr.Barry Katz from leaf litter See:
PubMed
Roles Classification
Chemical Role
(s):
Bronsted base
A molecular entity capable of accepting a hydron from a donor (Br
o
nsted acid).
(via
organic amino compound
)
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
Trichodepsipeptide B (
CHEBI:69614
)
has role
metabolite (
CHEBI:25212
)
Trichodepsipeptide B (
CHEBI:69614
)
is a
cyclodepsipeptide (
CHEBI:35213
)
Citation
Type
Source
21978324
PubMed citation
Europe PMC
Last Modified
22 September 2014
General Comment
2014-10-17
Suggested Classification: ISA:macrolide(CHEBI:25106); ISA:lactam(CHEBI:24995); ISA:alpha-amino acid ester(CHEBI:46874); ISA:keratan 6'-sulfate(CHEBI:18331); ISA:azamacrocycle(CHEBI:52898); ISA:aralkylamine(CHEBI:18000); ISA:benzenes(CHEBI:22712); ISA:dicarboxylic acid(CHEBI:35692); ISA:carboxamide(CHEBI:37622); ISA:lactone(CHEBI:25000); ISA:tertiary amine(CHEBI:32876); ISA:carboxylic ester(CHEBI:33308); ISA:carboxylic acid(CHEBI:33575); ISA:ether(CHEBI:25698); ISA:primary alcohol(CHEBI:15734); ISA:carbonyl compound(CHEBI:36586);