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ChEBI
> Main
CHEBI:143197 - culmorin
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ChEBI Ontology
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ChEBI Name
culmorin
ChEBI ID
CHEBI:143197
Definition
A sesquiterpenoid fungal metabolite isolated from
Fusarium culmorum
.
Stars
This entity has been manually annotated by the ChEBI Team.
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Formula
C15H26O2
Net Charge
0
Average Mass
238.371
Monoisotopic Mass
238.19328
InChI
InChI=1S/C15H26O2/c1-
13(2)
6-
5-
7-
14(3)
10-
9(16)
8-
15(14,4)
12(17)
11(10)
13/h9-
12,16-
17H,5-
8H2,1-
4H3/t9-
,10+,11+,12-
,14-
,15-
/m1/s1
InChIKey
VWMGBHVRRNKOAE-ZLSAFIHNSA-N
SMILES
[C@]12([C@@]3(CCCC([C@]([C@@]3([C@@H](C1)O)[H])([H])[C@H]2O)(C)C)C)C
Metabolite of Species
Details
Fusarium culmorum
(NCBI:txid5516)
See:
PubMed
Roles Classification
Biological Role
(s):
fungal metabolite
Any eukaryotic metabolite produced during a metabolic reaction in fungi, the kingdom that includes microorganisms such as the yeasts and moulds.
mycotoxin
Poisonous substance produced by fungi.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
culmorin (
CHEBI:143197
)
has role
fungal metabolite (
CHEBI:76946
)
culmorin (
CHEBI:143197
)
has role
mycotoxin (
CHEBI:25442
)
culmorin (
CHEBI:143197
)
is a
carbotricyclic compound (
CHEBI:38032
)
culmorin (
CHEBI:143197
)
is a
diol (
CHEBI:23824
)
culmorin (
CHEBI:143197
)
is a
secondary alcohol (
CHEBI:35681
)
culmorin (
CHEBI:143197
)
is a
sesquiterpenoid (
CHEBI:26658
)
IUPAC Name
(1
S
,3
R
,3a
S
,4
R
,8a
R
,9
R
)-
1,5,5,8a-
tetramethyldecahydro-
1,4-
methanoazulene-
3,9-
diol
Synonym
Source
(−)-culmorin
ChEBI
Manual Xref
Database
C00021971
KNApSAcK
View more database links
Registry Numbers
Types
Sources
18374-83-9
CAS Registry Number
KNApSAcK
18374-83-9
CAS Registry Number
ChemIDplus
Citations
Types
Sources
1034641
PubMed citation
Europe PMC
10866628
PubMed citation
Europe PMC
11122521
PubMed citation
Europe PMC
11694092
PubMed citation
Europe PMC
11761144
PubMed citation
Europe PMC
16746350
PubMed citation
Europe PMC
19880637
PubMed citation
Europe PMC
20740541
PubMed citation
Europe PMC
26673640
PubMed citation
Europe PMC
27690101
PubMed citation
Europe PMC
29465119
PubMed citation
Europe PMC
Last Modified
18 March 2019
General Comment
2019-03-04
Relevant Articles: 1) Barton, D.H.R (1968) The constitution and stereochemistry of culmorin. J. Chem. Soc. C., 0, 148-155. 2) Roberts, B.W., Poonian, M.S. and Welch S.C. (1969) Total synthesis of culmorin. J. Am. Chem. Soc., 91(12), 3400-3401.