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> Main
CHEBI:145110 - phyllostine
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ChEBI Ontology
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ChEBI Name
phyllostine
ChEBI ID
CHEBI:145110
Definition
An epoxide resulting from epoxidation of the 5-6 double bond of 2-(hydroxymethyl)-1,4-benzoquinone (the 5
S
,6
R
enantiomer).
Stars
This entity has been manually annotated by the ChEBI Team.
Submitter
Kristian Axelsen
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Formula
C7H6O4
Net Charge
0
Average Mass
154.121
Monoisotopic Mass
154.02661
InChI
InChI=1S/C7H6O4/c8-2-3-1-4(9)6-7(11-6)5(3)10/h1,6-8H,2H2/t6-,7+/m1/s1
InChIKey
PLELZLHJHUZIGY-RQJHMYQMSA-N
SMILES
C1(C(=CC([C@@H]2[C@H]1O2)=O)CO)=O
Metabolite of Species
Details
Nemania serpens
(NCBI:txid109381)
An endophytic fungus from a Riesling grapevine (Vitis vinifera) found in Canada's Niagara region See:
PubMed
Roles Classification
Biological Role
(s):
Penicillium metabolite
Any fungal metabolite produced during a metabolic reaction in
Penicillium
.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
phyllostine (
CHEBI:145110
)
has role
Penicillium
metabolite (
CHEBI:76964
)
phyllostine (
CHEBI:145110
)
is a
cyclic ketone (
CHEBI:3992
)
phyllostine (
CHEBI:145110
)
is a
epoxide (
CHEBI:32955
)
phyllostine (
CHEBI:145110
)
is a
primary allylic alcohol (
CHEBI:134394
)
IUPAC Name
(1
R
,6
S
)-3-(hydroxymethyl)-7-oxabicyclo[4.1.0]hept-3-ene-2,5-dione
Synonyms
Sources
(−)-phyllostine
SUBMITTER
5,6-epoxygentisylquinone
MetaCyc
epoxygentisylquinone
ChemIDplus
phyllostine
UniProt
Manual Xref
Database
CPD-16724
MetaCyc
View more database links
Registry Number
Type
Source
27270-89-9
CAS Registry Number
ChemIDplus
Citations
Types
Sources
22312735
PubMed citation
Europe PMC
23678814
PubMed citation
Europe PMC
2605253
PubMed citation
Europe PMC
28441516
PubMed citation
Europe PMC
418806
PubMed citation
Europe PMC
43192
PubMed citation
Europe PMC
508294
PubMed citation
SUBMITTER
Last Modified
22 August 2023