3'-Hydroxyechinenone

cas: 4481-36-1 — see every product listed under this CAS number, including other names

3'-Hydroxyechinenone (CAS 4481-36-1) is a chemical reagent available from Chemat. Available pack sizes: 10mg, 5mg, 25mg, 50mg. Offered by: Biosynth.

brandBiosynth
catalog numberEAA48136-10mg
cas4481-36-1
size10mg
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properties

categoryLife Sciences
purityNo data
delivery time3-4 Weeks
Structural formula: {0} (CAS {1})

3'-hydroxyechinenone is a member of the class of carotenone that is echinenone carrying an additional hydroxy substituent at position 3'. Found in cyanobacteria. It has a role as a cofactor, a biological pigment and a bacterial metabolite. It is a carotenone, a secondary alcohol and an enone. It is functionally related to an echinenone.

Source: ChEBI

Identity
Molecular formulaC40H54O2
Molecular weight566.9 g/mol
IUPAC name3-[(1E,3E,5E,7E,9E,11E,13E,15E,17E)-18-[(4R)-4-hydroxy-2,6,6-trimethylcyclohexen-1-yl]-3,7,12,16-tetramethyloctadeca-1,3,5,7,9,11,13,15,17-nonaenyl]-2,4,4-trimethylcyclohex-2-en-1-one
InChIKeyZRCXVNZZDQGBQT-BANQPSJHSA-N
SMILESCC1=C(C(C[C@@H](C1)O)(C)C)/C=C/C(=C/C=C/C(=C/C=C/C=C(\C)/C=C/C=C(\C)/C=C/C2=C(C(=O)CCC2(C)C)C)/C)/C

Computed by PubChem (NCBI)

Synonyms: 3'-Hydroxyechinenone, 3'-OH-Echinenone, (3'R)-3'-Hydroxy-beta,beta-caroten-4-one, hECN, (3'R)-3'-hydroxy-echinenone, 3'-hydroxy-beta,beta-caroten-4-one, 3'-Hydroxyechinenone/ 3'-OH-Echinenone, 3'-Hydroxyechinenone; 3'-OH-Echinenone, (3'R)-3'-Hydroxyechinenone; Asteroidenone; 3'-OH-Echinenone, HEQ
Isomers (same molecular formula)
(4R)-4-[(1E,3E,5E,7E,9E,11E,13E,15E,17E)-18-[(4R)-4-hydroxy-2,6,6-trimethylcyclohexen-1-yl]-3,7,12,16-tetramethyloctadeca-1,3,5,7,9,11,13,15,17-nonaenyl]-3,5,5-trimethylcyclohex-2-en-1-one C40H54O2
(1R)-4-[(1E,3E,5E,7E,9E,11E,13E,15E)-18-[(4R)-4-hydroxy-2,6,6-trimethylcyclohexen-1-yl]-3,7,12,16-tetramethyloctadeca-1,3,5,7,9,11,13,15-octaen-17-ynyl]-3,5,5-trimethylcyclohex-3-en-1-ol C40H54O2
(6S)-6-hydroxy-2,4,4-trimethyl-3-[(1E,3E,5E,7E,9E,11E,13E,15E,17E)-3,7,12,16-tetramethyl-18-(2,6,6-trimethylcyclohexen-1-yl)octadeca-1,3,5,7,9,11,13,15,17-nonaenyl]cyclohex-2-en-1-one C40H54O2
3-[(1E,3E,5E,7E,9E,11E,13E,15E,17E)-18-(3-hydroxy-2,6,6-trimethylcyclohexen-1-yl)-3,7,12,16-tetramethyloctadeca-1,3,5,7,9,11,13,15,17-nonaenyl]-2,4,4-trimethylcyclohex-2-en-1-one C40H54O2