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(Q74417391)
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English
11-dehydro-thromboxane B2(1-)
anion
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Statements
instance of
type of chemical entity
0 references
subclass of
organic anion
0 references
prostanoid anion
0 references
part of
11-hydroxythromboxane B2 dehydrogenase activity
1 reference
reference URL
http://geneontology.org/external2go/rhea2go
retrieved
1 February 2021
mass
367.2126122919099
dalton
1 reference
based on heuristic
inferred from isomeric SMILES
chemical formula
C₂₀H₃₁O₆⁻
1 reference
based on heuristic
inferred from SMILES
canonical SMILES
CCCCCC(O)C=CC1OC(=O)CC(O)C1CC=CCCCC(=O)[O-]
1 reference
based on heuristic
inferred from isomeric SMILES
isomeric SMILES
CCCCC[C@@H](/C=C/[C@@H]1[C@H]([C@H](CC(=O)O1)O)C/C=C\CCCC(=O)[O-])O
0 references
Identifiers
InChI
InChI=1S/C20H32O6/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/h4,7,12-13,15-18,21-22H,2-3,5-6,8-11,14H2,1H3,(H,23,24)/p-1/b7-4-,13-12+/t15-,16-,17-,18+/m0/s1
0 references
InChIKey
KJYIVXDPWBUJBQ-UHHGALCXSA-M
2 references
stated in
ChEBI release 2019-11-01
stated in
ChEBI release 2020-09-01
PubChem CID
25886395
1 reference
matched by identifier from
InChIKey
InChIKey
KJYIVXDPWBUJBQ-UHHGALCXSA-M
ChEBI ID
136539
mapping relation type
exact match
1 reference
matched by identifier from
International Chemical Identifier
InChI
InChI=1S/C20H32O6/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/h4,7,12-13,15-18,21-22H,2-3,5-6,8-11,14H2,1H3,(H,23,24)/p-1/b7-4-,13-12+/t15-,16-,17-,18+/m0/s1
UniChem compound ID
5433089
1 reference
stated in
UniChem
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