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ChEBI
> Main
CHEBI:72674 - versicolorin B
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ChEBI Ontology
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ChEBI Name
versicolorin B
ChEBI ID
CHEBI:72674
Definition
An organic heteropentacyclic compound that is 2,3,3a,12a-tetrahydroanthra[2,3-
b
]furo[3,2-
d
]furan-5,10-dione carrying three hydroxy substituents at positions 4, 6 and 8.
Stars
This entity has been manually annotated by the ChEBI Team.
Submitter
KAX
Supplier Information
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Formula
C18H12O7
Net Charge
0
Average Mass
340.28370
Monoisotopic Mass
340.05830
InChI
InChI=1S/C18H12O7/c19-
6-
3-
8-
12(10(20)
4-
6)
16(22)
14-
9(15(8)
21)
5-
11-
13(17(14)
23)
7-
1-
2-
24-
18(7)
25-
11/h3-
5,7,18-
20,23H,1-
2H2/t7-
,18+/m0/s1
InChIKey
BABJNKGTTYCTOO-ULCDLSAGSA-N
SMILES
[H][C@]12OCC[C@@]1([H])c1c(O)c3C(=O)c4c(O)cc(O)cc4C(=O)c3cc1O2
Metabolite of Species
Details
Aspergillus parasiticus
(NCBI:txid5067)
See:
PubMed
Roles Classification
Biological Role
(s):
Aspergillus metabolite
Any fungal metabolite produced during a metabolic reaction in the mould,
Aspergillus
.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
versicolorin B (
CHEBI:72674
)
has role
Aspergillus
metabolite (
CHEBI:76956
)
versicolorin B (
CHEBI:72674
)
is a
p
-quinones (
CHEBI:25830
)
versicolorin B (
CHEBI:72674
)
is a
cyclic acetal (
CHEBI:59770
)
versicolorin B (
CHEBI:72674
)
is a
organic heteropentacyclic compound (
CHEBI:38164
)
versicolorin B (
CHEBI:72674
)
is a
polyphenol (
CHEBI:26195
)
versicolorin B (
CHEBI:72674
)
is conjugate acid of
versicolorin B(1−) (
CHEBI:77951
)
Incoming
versicolorin B(1−) (
CHEBI:77951
)
is conjugate base of
versicolorin B (
CHEBI:72674
)
IUPAC Name
(3a
S
,12a
R
)-
4,6,8-
trihydroxy-
2,3,3a,12a-
tetrahydroanthra[2,3-
b
]furo[3,2-
d
]furan-
5,10-
dione
Manual Xref
Database
CPD-10175
MetaCyc
View more database links
Registry Numbers
Types
Sources
4331-22-0
CAS Registry Number
ChemIDplus
5634236
Reaxys Registry Number
Reaxys
Citations
Types
Sources
15184162
PubMed citation
Europe PMC
15932995
PubMed citation
Europe PMC
1731640
PubMed citation
SUBMITTER
22648070
PubMed citation
Europe PMC
8368837
PubMed citation
Europe PMC
8999832
PubMed citation
Europe PMC
Last Modified
06 June 2016