8–Acetoxy–15，16–epoxy–8，9–secolabda–13(16)，14–diene–7，9–dione

cas: 76497-89-7 — see every product listed under this CAS number, including other names

8–Acetoxy–15，16–epoxy–8，9–secolabda–13(16)，14–diene–7，9–dione (CAS 76497-89-7) is a chemical reagent available from Chemat. Available pack sizes: 5mg. Offered by: GLPBio.

brandGLPBio
catalog numberGF17742-5mg
cas76497-89-7
size5mg
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GLPBio 5mg 7828.41 Pln

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Structural formula: {0} (CAS {1})

[(2S)-4-[(1S,2S)-2-[3-(furan-3-yl)propanoyl]-2,6,6-trimethylcyclohexyl]-3-oxobutan-2-yl] acetate (CAS 76497-89-7) is a chemical compound with the molecular formula C22H32O5 and a molecular weight of 376.5 g/mol. IUPAC name: [(2S)-4-[(1S,2S)-2-[3-(furan-3-yl)propanoyl]-2,6,6-trimethylcyclohexyl]-3-oxobutan-2-yl] acetate. InChIKey: KMEPKEFHJNCARE-OHEPNIRZSA-N.

Identity
Molecular formulaC22H32O5
Molecular weight376.5 g/mol
IUPAC name[(2S)-4-[(1S,2S)-2-[3-(furan-3-yl)propanoyl]-2,6,6-trimethylcyclohexyl]-3-oxobutan-2-yl] acetate
InChIKeyKMEPKEFHJNCARE-OHEPNIRZSA-N
SMILESC[C@@H](C(=O)C[C@@H]1[C@@](CCCC1(C)C)(C)C(=O)CCC2=COC=C2)OC(=O)C

Computed by PubChem (NCBI)

Synonyms: 8-Acetoxy-15,16-epoxy-8,9-secolabda-13(16),14-diene-7,9-dione, (S)-8-Acetoxy-15,16-epoxy-8,9-secolabda-13(16),14-diene-7,9-dione, orb1681122, 8-Acetoxy-1516-epoxy-89-secolabda-13(16)14-diene-79-dione
Related forms of this compound
[(2R)-4-[(1S,2S)-2-[3-(furan-3-yl)propanoyl]-2,6,6-trimethylcyclohexyl]-3-oxobutan-2-yl] acetate C22H32O5
Isomers (same molecular formula)
(4Z,7S,8R,9E,11E,13Z,15E,17R,19Z)-7,8,17-trihydroxydocosa-4,9,11,13,15,19-hexaenoic acid C22H32O5
7,8,17-trihydroxydocosa-4,9,11,13,15,19-hexaenoic acid C22H32O5
(4Z,7S,8E,10Z,12E,14E,16R,17S,19Z)-7,16,17-trihydroxydocosa-4,8,10,12,14,19-hexaenoic acid C22H32O5
(6S,8S,9S,10R,11S,13S,14S,17R)-17-[(1R)-1,2-dihydroxyethyl]-11,17-dihydroxy-6,10,13-trimethyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-3-one C22H32O5
(6S,8S,9S,10R,11S,13S,14S,17R)-11,17-dihydroxy-17-(2-hydroxyacetyl)-6,10,13-trimethyl-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-3-one C22H32O5
(6S,8S,9S,10R,11S,13S,14S,17R)-17-[(1S)-1,2-dihydroxyethyl]-11,17-dihydroxy-6,10,13-trimethyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-3-one C22H32O5
3,5,6-trihydroxy-4,6-bis(3-methylbut-2-enyl)-2-(4-methylpentanoyl)cyclohexa-2,4-dien-1-one C22H32O5
(6S,8S,9S,10R,11S,13S,14S,17R)-17-(1,2-dihydroxyethyl)-11,17-dihydroxy-6,10,13-trimethyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-3-one C22H32O5
[(1S,2R,4aS,8aS)-1-[2-(furan-3-yl)ethyl]-1-hydroxy-2,5,5,8a-tetramethyl-3-oxo-4a,6,7,8-tetrahydro-4H-naphthalen-2-yl] acetate C22H32O5
15-acetyloxy-11-hydroxy-5,9-dimethyl-14-methylidenetetracyclo[11.2.1.01,10.04,9]hexadecane-5-carboxylic acid C22H32O5
(4S,5R,6E,8E,10Z,13Z,15E,17S,19Z)-4,5,17-trihydroxydocosa-6,8,10,13,15,19-hexaenoic acid C22H32O5

Also listed as

(S)-8-Acetoxy-15,16-epoxy-8,9-secolabda-13(16),14-diene-7,9-dione MedChemExpress CAS 76497-89-7