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(Q105126638)
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English
2-[3-Oxo-2-[5-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxypent-2-enyl]cyclopentyl]acetic acid
group of stereoisomers with the chemical formula C₁₈H₂₈O₉
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Statements
instance of
group of stereoisomers
0 references
subclass of
chemical compound
0 references
mass
388.173332476
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₈H₂₈O₉
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canonical SMILES
O=C(O)CC1CCC(=O)C1CC=CCCOC2OC(CO)C(O)C(O)C2O
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found in taxon
Phyllanthus
1 reference
stated in
Two new acylated flavanone glycosides from the leaves and branches of Phyllanthus emblica
potato
1 reference
stated in
Structure of a Tuber-inducing Stimulus from Potato Leaves (Solanum tuberosum L.)
broad bean
1 reference
stated in
UHPLC-ESI-QTOF-MS-based metabolic profiling of Vicia faba L. (Fabaceae) seeds as a key strategy for characterization in foodomics
Identifiers
InChI
InChI=1S/C18H28O9/c19-9-13-15(23)16(24)17(25)18(27-13)26-7-3-1-2-4-11-10(8-14(21)22)5-6-12(11)20/h1-2,10-11,13,15-19,23-25H,3-9H2,(H,21,22)
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InChIKey
JFDNMLUPLXZXGV-UHFFFAOYSA-N
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PubChem CID
4480898
1 reference
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
ChEBI ID
139442
mapping relation type
exact match
1 reference
stated in
ChEBI release 2021-03-01
UniChem compound ID
55548052
1 reference
stated in
UniChem
MassBank accession ID
MSBNK-RIKEN-PR309339
1 reference
InChIKey
JFDNMLUPLXZXGV-UHFFFAOYSA-N
stated in
MassBank/MassBank-data: release version 2022.06 to wikidata
retrieved
4 September 2022
based on heuristic
InChIKey match
MSBNK-RIKEN-PR309340
1 reference
InChIKey
JFDNMLUPLXZXGV-UHFFFAOYSA-N
stated in
MassBank/MassBank-data: release version 2022.06 to wikidata
retrieved
4 September 2022
based on heuristic
InChIKey match
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