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InChI=1S/CH4O/c1-2/h2H,1H3
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ChEBI
> Main
CHEBI:4478 - Diacetoxyscirpenol
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ChEBI Ontology
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ChEBI Name
Diacetoxyscirpenol
ChEBI ID
CHEBI:4478
Stars
This entity has been manually annotated by a third party.
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Formula
C19H26O7
Net Charge
0
Average Mass
366.406
Monoisotopic Mass
366.16785
InChI
InChI=1S/C19H26O7/c1-
10-
5-
6-
18(8-
23-
11(2)
20)
13(7-
10)
26-
16-
14(22)
15(25-
12(3)
21)
17(18,4)
19(16)
9-
24-
19/h7,13-
16,22H,5-
6,8-
9H2,1-
4H3/t13-
,14-
,15-
,16-
,17-
,18-
,19-
/m1/s1
InChIKey
AUGQEEXBDZWUJY-ZLJUKNTDSA-N
SMILES
CC(=O)OC[C@]12CCC(C)=C[C@H]1O[C@@H]1[C@H](O)[C@@H](OC(C)=O)[C@@]2(C)[C@@]11CO1
Roles Classification
Biological Role
(s):
mycotoxin
Poisonous substance produced by fungi.
(via
trichothecene
)
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
Diacetoxyscirpenol (
CHEBI:4478
)
is a
trichothecene (
CHEBI:55517
)
Synonym
Source
Diacetoxyscirpenol
KEGG COMPOUND
Manual Xrefs
Databases
C00003129
KNApSAcK
C09662
KEGG COMPOUND
View more database links
Registry Number
Type
Source
2270-40-8
CAS Registry Number
KEGG COMPOUND
Last Modified
28 July 2014