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CHEBI:60092 - SL659
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ChEBI Ontology
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ChEBI Name
SL659
ChEBI ID
CHEBI:60092
Definition
The 2-
O
-sulfonato-2'-
O
-hexadecanoyl derivative of α,α-trehalose.
Stars
This entity has been manually annotated by the ChEBI Team.
Submitter
R. Stephan
Supplier Information
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Formula
C28H51O15S
Net Charge
-1
Average Mass
659.76100
Monoisotopic Mass
659.29542
InChI
InChI=1S/C28H52O15S/c1-
2-
3-
4-
5-
6-
7-
8-
9-
10-
11-
12-
13-
14-
15-
20(31)
41-
25-
23(34)
21(32)
18(16-
29)
39-
27(25)
42-
28-
26(43-
44(36,37)
38)
24(35)
22(33)
19(17-
30)
40-
28/h18-
19,21-
30,32-
35H,2-
17H2,1H3,(H,36,37,38)
/p-
1/t18-
,19-
,21-
,22-
,23+,24+,25-
,26-
,27-
,28-
/m1/s1
InChIKey
AKFSXZFFUZRYPP-FJUFGMPQSA-M
SMILES
CCCCCCCCCCCCCCCC(=O)
O[C@@H]
1[C@@H]
(O)
[C@H]
(O)
[C@@H]
(CO)
O[C@@H]
1O[C@H]
1O[C@H]
(CO)
[C@@H]
(O)
[C@H]
(O)
[C@H]
1OS([O-
]
)
(=O)
=O
ChEBI Ontology
Outgoing
SL659 (
CHEBI:60092
)
has functional parent
α,α-trehalose (
CHEBI:16551
)
SL659 (
CHEBI:60092
)
is a
organosulfate oxoanion (
CHEBI:58958
)
SL659 (
CHEBI:60092
)
is a
polyacyl α,α-trehalose derivative (
CHEBI:62552
)
SL659 (
CHEBI:60092
)
is a
trehalose sulfate (
CHEBI:60117
)
IUPAC Name
2-
O
-
sulfonato-
α-
D
-
glucopyranosyl 2-
O
-
hexadecanoyl-
α-
D
-
glucopyranoside
Synonym
Source
2-
O
-sulfo-2ʼ-
O
-hexadecanoyl-α,α-trehalose
UniProt
Citation
Type
Source
17592143
PubMed citation
SUBMITTER
Last Modified
09 December 2014