(Q113947836)

English

2-[(1S,2R)-3-oxo-2-pentylcyclopentyl]acetic acid

chemical compound

In more languages

Statements

type of chemical entity

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chemical compound

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212.1412445 dalton

1 reference

based on heuristic

inferred from isomeric SMILES

stereoisomer of

[(1R,2S)-3-oxo-2-pentylcyclopentyl]acetic acid

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

(+)-9,10-dihydrojasmonic acid

1 reference

based on heuristic

inferred from InChI

(-)-9,10-dihydrojasmonic acid

1 reference

based on heuristic

inferred from InChI

chemical formula

C₁₂H₂₀O₃

1 reference

based on heuristic

inferred from SMILES

canonical SMILES

CCCCCC1C(=O)CCC1CC(=O)O

1 reference

based on heuristic

inferred from isomeric SMILES

isomeric SMILES

CCCCC[C@@H]1[C@@H](CCC1=O)CC(=O)O

1 reference

based on heuristic

inferred from SMILES

Identifiers

InChI=1S/C12H20O3/c1-2-3-4-5-10-9(8-12(14)15)6-7-11(10)13/h9-10H,2-8H2,1H3,(H,14,15)/t9-,10+/m0/s1

1 reference

based on heuristic

inferred from SMILES

PQEYTAGBXNEUQL-VHSXEESVSA-N

0 references

2 references

based on heuristic

inferred from InChIKey

matched by identifier from

PQEYTAGBXNEUQL-VHSXEESVSA-N

mapping relation type

1 reference

matched by identifier from

International Chemical Identifier

InChI=1S/C12H20O3/c1-2-3-4-5-10-9(8-12(14)15)6-7-11(10)13/h9-10H,2-8H2,1H3,(H,14,15)/t9-,10+/m0/s1

UniChem compound ID

1 reference

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