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(Q74411531)
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English
12-dehydro-leukotriene B4(1-)
anion
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No label defined
No description defined
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Statements
instance of
type of chemical entity
0 references
subclass of
organic anion
0 references
icosanoid anion
0 references
part of
leukotriene B4 12-hydroxy dehydrogenase activity
1 reference
reference URL
http://geneontology.org/external2go/rhea2go
retrieved
1 February 2021
mass
333.20713298791
dalton
1 reference
based on heuristic
inferred from isomeric SMILES
stereoisomer of
12-oxo-6-trans-leukotriene B4(1-)
1 reference
based on heuristic
inferred from InChI
chemical formula
C₂₀H₂₉O₄⁻
1 reference
based on heuristic
inferred from SMILES
canonical SMILES
CCCCCC=CCC(=O)C=CC=CC=CC(O)CCCC(=O)[O-]
1 reference
based on heuristic
inferred from isomeric SMILES
isomeric SMILES
CCCCC/C=C\CC(=O)/C=C/C=C/C=C\[C@H](CCCC(=O)[O-])O
0 references
Identifiers
InChI
InChI=1S/C20H30O4/c1-2-3-4-5-6-9-13-18(21)14-10-7-8-11-15-19(22)16-12-17-20(23)24/h6-11,14-15,19,22H,2-5,12-13,16-17H2,1H3,(H,23,24)/p-1/b8-7+,9-6-,14-10+,15-11-/t19-/m1/s1
0 references
InChIKey
SJVWVCVZWMJXOK-NOJHDUNKSA-M
2 references
stated in
ChEBI release 2019-11-01
stated in
ChEBI release 2020-09-01
PubChem CID
122164871
1 reference
matched by identifier from
InChIKey
InChIKey
SJVWVCVZWMJXOK-NOJHDUNKSA-M
ChEBI ID
133309
mapping relation type
exact match
1 reference
matched by identifier from
International Chemical Identifier
InChI
InChI=1S/C20H30O4/c1-2-3-4-5-6-9-13-18(21)14-10-7-8-11-15-19(22)16-12-17-20(23)24/h6-11,14-15,19,22H,2-5,12-13,16-17H2,1H3,(H,23,24)/p-1/b8-7+,9-6-,14-10+,15-11-/t19-/m1/s1
UniChem compound ID
83276813
1 reference
stated in
UniChem
SwissLipids ID
SLM:000597640
1 reference
matched by identifier from
InChIKey
InChIKey
SJVWVCVZWMJXOK-NOJHDUNKSA-M
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