dinor-12-oxo Phytodienoic Acid

cas: 197247-23-7 — see every product listed under this CAS number, including other names

dinor-12-oxo Phytodienoic Acid (CAS 197247-23-7) is a chemical reagent available from Chemat. Available pack sizes: on request, 500 μg, 100 μg. Offered by: Chemat Brand, MedChemExpress.

brandChemat Brand
catalog numberRM-P107100
cas197247-23-7
sizeon request
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Available pack sizes

brand size price
Chemat Brand on request price on request
MedChemExpress 500 μg 6603.02 Pln
MedChemExpress 100 μg 1578.22 Pln

properties

purityNo data
delivery timeTo be confirmed by Chemat
Structural formula: {0} (CAS {1})

6-{(1S,5S)-4-oxo-5-[(2Z)-pent-2-en-1-yl]cyclopent-2-en-1-yl}hexanoic acid is a carbocyclic fatty acid that is cyclopent-2-en-1-one which has been substituted at positions 4 and 5 by 5-carboxypentyl and (2ZZ)-pent-2-en-1-yl groups, respectively (the S,S stereoisomer). It is an intermediate in the synthesis of jasmonic acid from hexadecatrienoic acid. It is a polyunsaturated fatty acid, a carbocyclic fatty acid, an enone and an oxo fatty acid. It is a conjugate acid of a 6-{(1S,5S)-4-oxo-5-[(2Z)-pent-2-en-1-yl]cyclopent-2-en-1-yl}hexanoate.

Source: ChEBI

Identity
Molecular formulaC16H24O3
Molecular weight264.36 g/mol
IUPAC name6-[(1S,5S)-4-oxo-5-[(Z)-pent-2-enyl]cyclopent-2-en-1-yl]hexanoic acid
InChIKeySZVNKXCDJUBPQO-DWMAKUKJSA-N
SMILESCC/C=C\C[C@H]1[C@H](C=CC1=O)CCCCCC(=O)O

Computed by PubChem (NCBI)

Synonyms: dinor-12-oxo Phytodienoic Acid, dinor-12-oxo PDA, 6-[(1S,5S)-4-oxo-5-[(Z)-pent-2-enyl]cyclopent-2-en-1-yl]hexanoic acid, 4-Oxo-5S-(2Z)-2-penten-1-yl-2-cyclopentene-1S-hexanoic acid, dinor-OPDA, 6-{(1S,5S)-4-oxo-5-[(2Z)-pent-2-en-1-yl]cyclopent-2-en-1-yl}hexanoic acid, Dinor-oxo-phytodienoic acid, dinor-12-oxo-phytodienoic acid, Dinor-12-oxophytodienoic Acid, 4-?oxo-?5S-?(2Z)-?2-?penten-?1-?yl-?2-?cyclopentene-?1S-?hexanoic acid
Isomers (same molecular formula)
methyl 5-(2,5-dimethylphenoxy)-2,2-dimethylpentanoate C16H24O3
2-(2,4-ditert-butylphenoxy)acetic acid C16H24O3
nonyl 4-hydroxybenzoate C16H24O3
methyl 4-octoxybenzoate C16H24O3
2-hydroxypropyl 2-[4-(2-methylpropyl)phenyl]propanoate C16H24O3
ethyl 3-(3-tert-butyl-4-hydroxy-5-methylphenyl)propanoate C16H24O3
methyl 3,5-ditert-butyl-4-hydroxybenzoate C16H24O3
4-nonoxybenzoic acid C16H24O3
2-(3,5-ditert-butyl-4-hydroxyphenyl)acetic acid C16H24O3
butyl 2-(4-butoxyphenyl)acetate C16H24O3
(2,6-ditert-butyl-4-hydroxyphenyl) acetate C16H24O3
2-[4-(2,4,4-trimethylpentan-2-yl)phenoxy]acetic acid C16H24O3

Also listed as

Dinor-12-oxo-phytodienoic Acid TRC CAS 197247-23-7
dinor–12–oxo Phytodienoic Acid–d5 GLPBio CAS 197247-23-7
dinor–12–oxo Phytodienoic Acid GLPBio CAS 197247-23-7