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ChEBI
> Main
CHEBI:70521 - Meliasenin M, (rel)-
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ChEBI Name
Meliasenin M, (rel)-
ChEBI ID
CHEBI:70521
Definition
A natural product found in
Melia toosendan
.
Stars
This entity has been manually annotated by a third party.
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Formula
C30H44O5
Net Charge
0
Average Mass
484.66740
Monoisotopic Mass
484.31887
InChI
InChI=1S/C30H44O5/c1-
26(2,35-
33)
14-
8-
9-
18-
24-
21(34-
25(18)
32)
17-
30(7)
20-
10-
11-
22-
27(3,4)
23(31)
13-
15-
28(22,5)
19(20)
12-
16-
29(24,30)
6/h8,10,14,18-
19,21-
22,24,33H,9,11-
13,15-
17H2,1-
7H3/b14-
8+/t18-
,19+,21+,22+,24-
,28-
,29+,30-
/m1/s1
InChIKey
LQPSEQWINGOYLK-UHVZVPEASA-N
SMILES
[H]
[C@]
12C[C@]
3(C)
C4=CC[C@@]
5([H]
)
C(C)
(C)
C(=O)
CC[C@]
5(C)
[C@@]
4([H]
)
CC[C@@]
3(C)
[C@]
1([H]
)
[C@@]
([H]
)
(C\C=C\C(C)
(C)
OO)
C(=O)
O2
Metabolite of Species
Details
Melia toosendan
(NCBI:txid71608)
Found in fruit
(BTO:0000486)
. 95% ethanolic extract of dried fruits 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
Meliasenin M, (rel)- (
CHEBI:70521
)
has role
metabolite (
CHEBI:25212
)
Meliasenin M, (rel)- (
CHEBI:70521
)
is a
triterpenoid (
CHEBI:36615
)
Synonym
Source
rel-(23E)-25-hydroperoxyeupha-7,23-dien-3-oxo-16beta,21beta-olide
ChEBI
Citation
Type
Source
20961091
PubMed citation
Europe PMC
Last Modified
22 September 2014
General Comment
2014-10-17
Suggested Classification: ISA:steroid lactone(CHEBI:26766); ISA:3-oxo Delta(7)-steroid(CHEBI:71598); ISA:3-oxo steroid(CHEBI:47788); ISA:steroid(CHEBI:35341); ISA:terpene lactone(CHEBI:37668); ISA:cyclohexanones(CHEBI:23482); ISA:gamma-lactone(CHEBI:37581); ISA:oxolanes(CHEBI:26912); ISA:carboxylic ester(CHEBI:33308); ISA:peroxol(CHEBI:35924); ISA:ether(CHEBI:25698);