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(Q106039049)
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English
2,3-Dinor-11b-PGF2alpha
chemical compound
(Z)-5-[(1R,2R,3S,5S)-3,5-dihydroxy-2-[(E,3S)-3-hydroxyoct-1-enyl]cyclopentyl]pent-3-enoic acid
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Statements
instance of
type of chemical entity
0 references
subclass of
prostaglandins
0 references
mass
326.2093240599999
dalton
1 reference
based on heuristic
inferred from isomeric SMILES
stereoisomer of
2,3-dinor-8-epi-prostaglandin F2alpha
1 reference
based on heuristic
inferred from InChI
dinor-PGF2alpha
1 reference
based on heuristic
inferred from InChI
chemical formula
C₁₈H₃₀O₅
1 reference
based on heuristic
inferred from SMILES
canonical SMILES
CCCCCC(O)C=CC1C(O)CC(O)C1CC=CCC(=O)O
0 references
isomeric SMILES
[C@H]1(/C=C/[C@@H](O)CCCCC)[C@@H](O)C[C@H](O)[C@@H]1C/C=C\CC(=O)O
0 references
Identifiers
InChI
InChI=1S/C18H30O5/c1-2-3-4-7-13(19)10-11-15-14(16(20)12-17(15)21)8-5-6-9-18(22)23/h5-6,10-11,13-17,19-21H,2-4,7-9,12H2,1H3,(H,22,23)/b6-5-,11-10+/t13-,14+,15+,16-,17-/m0/s1
1 reference
stated in
ChEBI release 2021-03-01
InChIKey
IDKLJIUIJUVJNR-KSJYGFEGSA-N
1 reference
stated in
ChEBI release 2021-03-01
PubChem CID
5283032
2 references
stated in
ChEBI release 2021-03-01
matched by identifier from
InChIKey
InChIKey
IDKLJIUIJUVJNR-KSJYGFEGSA-N
ChEBI ID
165323
mapping relation type
exact match
2 references
stated in
ChEBI release 2021-03-01
matched by identifier from
International Chemical Identifier
InChI
InChI=1S/C18H30O5/c1-2-3-4-7-13(19)10-11-15-14(16(20)12-17(15)21)8-5-6-9-18(22)23/h5-6,10-11,13-17,19-21H,2-4,7-9,12H2,1H3,(H,22,23)/b6-5-,11-10+/t13-,14+,15+,16-,17-/m0/s1
UniChem compound ID
27325171
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID10849523
1 reference
matched by identifier from
InChIKey
InChIKey
IDKLJIUIJUVJNR-KSJYGFEGSA-N
Probes And Drugs ID
PD020576
0 references
LIPID MAPS ID
LMFA03010011
1 reference
InChIKey
IDKLJIUIJUVJNR-KSJYGFEGSA-N
stated in
LIPID MAPS
retrieved
17 April 2021
reference URL
http://www.lipidmaps.org/rest/compound/lm_id/LM/all/download
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