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ChEBI
> Main
CHEBI:73994 - thromboxane B
1
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ChEBI Name
thromboxane B
1
ChEBI ID
CHEBI:73994
ChEBI ASCII Name
thromboxane B1
Definition
A thromboxane B that is thromboxane B
2
in which the double bond at position 5-6 has been reduced to a single bond.
Stars
This entity has been manually annotated by the ChEBI Team.
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Formula
C20H36O6
Net Charge
0
Average Mass
372.49620
Monoisotopic Mass
372.25119
InChI
InChI=1S/C20H36O6/c1-
2-
3-
6-
9-
15(21)
12-
13-
18-
16(17(22)
14-
20(25)
26-
18)
10-
7-
4-
5-
8-
11-
19(23)
24/h12-
13,15-
18,20-
22,25H,2-
11,14H2,1H3,(H,23,24)
/b13-
12+/t15-
,16-
,17-
,18+,20?/m0/s1
InChIKey
JSDWWNLTJCCSAV-VZBVYBAISA-N
SMILES
CCCCC[C@H](O)\C=C\[C@H]1OC(O)C[C@H](O)[C@@H]1CCCCCCC(O)=O
Roles Classification
Chemical Role
(s):
Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Br
o
nsted base).
(via
oxoacid
)
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
thromboxane B
1
(
CHEBI:73994
)
is a
monocarboxylic acid (
CHEBI:25384
)
thromboxane B
1
(
CHEBI:73994
)
is a
thromboxanes B (
CHEBI:26996
)
Incoming
2,3,4,5-tetranor-thromboxane B
1
(
CHEBI:74003
)
has functional parent
thromboxane B
1
(
CHEBI:73994
)
IUPAC Name
(9β,13
E
,15
S
)-9,11,15-trihydroxythrombox-13-en-1-oic acid
Synonyms
Sources
(9
S
,13
E
,15
S
)-9,11,15-trihydroxythrombox-13-en-1-oic acid
IUPAC
TXB1
LIPID MAPS
Registry Number
Type
Source
2510927
Reaxys Registry Number
Reaxys
Last Modified
31 July 2013