Desacetyl Nimbin, >95% (HPLC)

cas: 18609-16-0 — see every product listed under this CAS number, including other names

Desacetyl Nimbin, >95% (HPLC) (CAS 18609-16-0) is a chemical reagent available from Chemat. Available pack sizes: 10mg, 1mg. Offered by: TRC.

brandTRC
catalog numberTRC-D199000-10MG
cas18609-16-0
size10mg
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Available pack sizes

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TRC 10mg price on request
TRC 1mg price on request

properties

purity>95% (HPLC)
delivery timeTo be confirmed by Chemat
Structural formula: {0} (CAS {1})

6-deacetylnimbin is a limonoid that is nimbin in which the acetyloxy group at position 6 is replaced by a hydroxy hroup. It has been isolated from Azadirachta indica. It has a role as an antifeedant, an insect growth regulator and a plant metabolite. It is a member of furans, a methyl ester, a tetracyclic triterpenoid, a cyclic terpene ketone, a limonoid, a diester and an enone. It is functionally related to a nimbin.

Source: ChEBI

Identity
Molecular formulaC28H34O8
Molecular weight498.6 g/mol
IUPAC namemethyl (1S,2R,3R,4R,8R,9S,10R,13R,15R)-13-(furan-3-yl)-2-hydroxy-9-(2-methoxy-2-oxoethyl)-4,8,10,12-tetramethyl-7-oxo-16-oxatetracyclo[8.6.0.03,8.011,15]hexadeca-5,11-diene-4-carboxylate
InChIKeyCTBHKOAPXBDFPX-PQYHCQQJSA-N
SMILESCC1=C2[C@@H](C[C@H]1C3=COC=C3)O[C@H]4[C@@]2([C@@H]([C@@]5([C@@H]([C@H]4O)[C@](C=CC5=O)(C)C(=O)OC)C)CC(=O)OC)C

Computed by PubChem (NCBI)

Synonyms: Deacetylnimbin, 6-Deacetylnimbin, Desacetylnimbin, Desacetyl Nimbin, nimbic acid dimethyl ester, Deacetylnimbin; Desacetylnimbin, Nimbin, O-de-acetyl derivative of
Isomers (same molecular formula)
(3,4,5,19-tetramethoxy-9,10-dimethyl-15,17-dioxatetracyclo[10.7.0.02,7.014,18]nonadeca-1(19),2,4,6,12,14(18)-hexaen-11-yl) 2-methylbut-2-enoate C28H34O8
[(9S,10S,11S)-3,4,5,19-tetramethoxy-9,10-dimethyl-15,17-dioxatetracyclo[10.7.0.02,7.014,18]nonadeca-1(19),2,4,6,12,14(18)-hexaen-11-yl] (Z)-2-methylbut-2-enoate C28H34O8
6-acetyl-7-[5-(4-acetyl-3-hydroxy-2-propylphenoxy)pentoxy]-3,4-dihydro-2H-chromene-2-carboxylic acid C28H34O8
[(8R,9S,10S)-3,4,5,19-tetramethoxy-9,10-dimethyl-15,17-dioxatetracyclo[10.7.0.02,7.014,18]nonadeca-1(19),2,4,6,12,14(18)-hexaen-8-yl] (Z)-2-methylbut-2-enoate C28H34O8
[(8R,9S,10S)-3,4,5,19-tetramethoxy-9,10-dimethyl-15,17-dioxatetracyclo[10.7.0.02,7.014,18]nonadeca-1(19),2,4,6,12,14(18)-hexaen-8-yl] (E)-2-methylbut-2-enoate C28H34O8
[(9S,10S,11R)-3,4,5,19-tetramethoxy-9,10-dimethyl-15,17-dioxatetracyclo[10.7.0.02,7.014,18]nonadeca-1(19),2,4,6,12,14(18)-hexaen-11-yl] (Z)-2-methylbut-2-enoate C28H34O8
methyl 2-[(1R,2S,4R,6R,9R,10S,11R,14R,15S,18R)-6-(furan-3-yl)-14-methoxy-7,9,11,15-tetramethyl-12,16-dioxo-3,17-dioxapentacyclo[9.6.1.02,9.04,8.015,18]octadec-7-en-10-yl]acetate C28H34O8
methyl 2-[(1S,2R,3S,4R,8R,9S,10R,13R,15R)-2-acetyloxy-13-(furan-3-yl)-4-hydroxy-4,8,10,12-tetramethyl-7-oxo-16-oxatetracyclo[8.6.0.03,8.011,15]hexadeca-5,11-dien-9-yl]acetate C28H34O8
(1R,4S,5Z,7R,8S)-7-[(E)-hex-4-enoyl]-3-hydroxy-8-[(2R)-3-hydroxy-2,4-dimethyl-5-oxofuran-2-yl]-5-[(2E,4E)-1-hydroxyhexa-2,4-dienylidene]-1,3-dimethylbicyclo[2.2.2]octane-2,6-dione C28H34O8

Also listed as

Deacetylnimbin TargetMol CAS 18609-16-0
6-Desacetylnimbin Biosynth CAS 18609-16-0