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(Q105161787)
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Dihydromalyngic acid
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
9,12,13-trihydroxyoctadec-10-enoic acid
1 reference
based on heuristic
inferred from SMILES
(10E)-9,12,13-trihydroxyoctadec-10-enoic acid
1 reference
based on heuristic
inferred from SMILES
mass
330.240624188
dalton
1 reference
based on heuristic
inferred from SMILES
stereoisomer of
9S,12R,13S-trihydroxy-10E-octadecenoic acid
2 references
based on heuristic
inferred from InChIKey
based on heuristic
inferred from InChI
pinellic acid
2 references
based on heuristic
inferred from InChIKey
based on heuristic
inferred from InChI
9R,12R,13S-trihydroxy-10E-octadecenoic acid
2 references
based on heuristic
inferred from InChIKey
based on heuristic
inferred from InChI
(9R,10E,12S,13S)-9,12,13-Trihydroxy-10-octadecenoic acid
2 references
based on heuristic
inferred from InChIKey
based on heuristic
inferred from InChI
9R,12S,13R-trihydroxy-10E-octadecenoic acid
1 reference
based on heuristic
inferred from InChI
9S,12R,13R-trihydroxy-10E-octadecenoic acid
1 reference
based on heuristic
inferred from InChI
(+)-Pinellic acid
1 reference
based on heuristic
inferred from InChI
chemical formula
C₁₈H₃₄O₅
0 references
canonical SMILES
O=C(O)CCCCCCCC(O)C=CC(O)C(O)CCCCC
0 references
isomeric SMILES
CCCCC[C@@H](O)[C@@H](O)/C=C/[C@@H](O)CCCCCCCC(=O)O
0 references
found in taxon
Caroxylon tetrandrum
1 reference
stated in
Phytochemical constituents from Salsola tetrandra.
Rourea minor
1 reference
stated in
Rourinoside and rouremin, antimalarial constituents from Rourea minor.
Identifiers
InChI
InChI=1S/C18H34O5/c1-2-3-7-11-16(20)17(21)14-13-15(19)10-8-5-4-6-9-12-18(22)23/h13-17,19-21H,2-12H2,1H3,(H,22,23)/b14-13+/t15-,16+,17-/m0/s1
0 references
InChIKey
MDIUMSLCYIJBQC-XFMWCYPDSA-N
0 references
PubChem CID
14414119
1 reference
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
UniChem compound ID
34401738
1 reference
stated in
UniChem
LIPID MAPS ID
LMFA02000294
1 reference
InChIKey
MDIUMSLCYIJBQC-XFMWCYPDSA-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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