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InChI=1S/CH4O/c1-2/h2H,1H3
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ChEBI
> Main
CHEBI:7879 - PM-Toxin A
Main
ChEBI Ontology
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ChEBI Name
PM-Toxin A
ChEBI ID
CHEBI:7879
Stars
This entity has been manually annotated by a third party.
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Formula
C33H60O8
Net Charge
0
Average Mass
584.826
Monoisotopic Mass
584.42882
InChI
InChI=1S/C33H60O8/c1-
3-
4-
8-
15-
28(36)
23-
29(37)
18-
11-
6-
12-
19-
32(40)
25-
33(41)
21-
14-
7-
13-
20-
31(39)
24-
30(38)
17-
10-
5-
9-
16-
27(35)
22-
26(2)
34/h27-
28,31-
32,35-
36,39-
40H,3-
25H2,1-
2H3/t27-
,28-
,31-
,32-
/m1/s1
InChIKey
RFJUKGGHUDCGDN-QWWQXMGCSA-N
SMILES
CCCCC[C@@H](O)CC(=O)CCCCC[C@@H](O)CC(=O)CCCCC[C@@H](O)CC(=O)CCCCC[C@@H](O)CC(C)=O
ChEBI Ontology
Outgoing
PM-Toxin A (
CHEBI:7879
)
is a
aliphatic alcohol (
CHEBI:2571
)
Synonym
Source
PM-Toxin A
KEGG COMPOUND
Manual Xrefs
Databases
C00001325
KNApSAcK
C08553
KEGG COMPOUND
View more database links
Registry Number
Type
Source
88212-12-8
CAS Registry Number
KEGG COMPOUND
Last Modified
28 July 2014