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CHEBI:66515 - sorocenol H
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ChEBI Ontology
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ChEBI Name
sorocenol H
ChEBI ID
CHEBI:66515
Definition
A member of the class of 1-benzofurans isolated from
Sorocea muriculata
that has been shown to exhibit antibacterial activity against methicillin-resistant
Staphylococcus aureus
.
Stars
This entity has been manually annotated by the ChEBI Team.
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Formula
C39H36O9
Net Charge
0
Average Mass
648.69770
Monoisotopic Mass
648.23593
InChI
InChI=1S/C39H36O9/c1-
19(2)
4-
8-
26-
30(42)
11-
10-
27(38(26)
46)
39(47)
36-
28(25-
9-
7-
23(40)
17-
31(25)
43)
12-
20(3)
13-
29(36)
37-
32(44)
14-
22(15-
33(37)
45)
34-
16-
21-
5-
6-
24(41)
18-
35(21)
48-
34/h4-
7,9-
11,13-
18,28-
29,36,40-
46H,8,12H2,1-
3H3/t28-
,29+,36+/m0/s1
InChIKey
SEHVRKPXIDOTRX-CMUUVTEDSA-N
SMILES
CC(C)=CCc1c(O)ccc(C(=O)[C@@H]2[C@@H](CC(C)=C[C@H]2c2c(O)cc(cc2O)-c2cc3ccc(O)cc3o2)c2ccc(O)cc2O)c1O
Metabolite of Species
Details
Sorocea muriculata
(NCBI:txid241923)
Found in root
(BTO:0001188)
. See:
PubMed
Roles Classification
Biological Role
(s):
antibacterial agent
A substance (or active part thereof) that kills or slows the growth of bacteria.
antifungal agent
An antimicrobial agent that destroys fungi by suppressing their ability to grow or reproduce.
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
sorocenol H (
CHEBI:66515
)
has role
antibacterial agent (
CHEBI:33282
)
sorocenol H (
CHEBI:66515
)
has role
antifungal agent (
CHEBI:35718
)
sorocenol H (
CHEBI:66515
)
has role
metabolite (
CHEBI:25212
)
sorocenol H (
CHEBI:66515
)
is a
1-benzofurans (
CHEBI:38830
)
sorocenol H (
CHEBI:66515
)
is a
aromatic ketone (
CHEBI:76224
)
sorocenol H (
CHEBI:66515
)
is a
resorcinols (
CHEBI:33572
)
IUPAC Name
[(1
R
,2
R
,6
R
)-
2-
[2,6-
dihydroxy-
4-
(6-
hydroxy-
1-
benzofuran-
2-
yl)phenyl]-
6-
(2,4-
dihydroxyphenyl)-
4-
methylcyclohex-
3-
en-
1-
yl][2,4-
dihydroxy-
3-
(3-
methylbut-
2-
en-
1-
yl)phenyl]methanone
Registry Number
Type
Source
19203598
Reaxys Registry Number
Reaxys
Citation
Type
Source
18847244
PubMed citation
Europe PMC
Last Modified
07 November 2013