bruceine D, 95%, 95%

cas: 21499-66-1 — see every product listed under this CAS number, including other names

bruceine D, 95%, 95% (CAS 21499-66-1) is a chemical reagent available from Chemat. Available pack sizes: 1mg, 5mg, 10mg, 25mg, 50mg, 100mg, 250mg. Offered by: Chemat.

brandChemat
catalog numberCh114OKX-1mg
cas21499-66-1
size1mg
availability 0.75g
Need more information?

Ask us about this product — we're happy to help.

Available pack sizes

brand size price
Chemat 1mg 136.40 Pln
Chemat 5mg 294.80 Pln
Chemat 10mg 414.80 Pln
Chemat 25mg 659.60 Pln
Chemat 50mg 1077.20 Pln
Chemat 100mg 1888.40 Pln
Chemat 250mg 3712.40 Pln

properties

purity95%
delivery time3 weeks
Structural formula: {0} (CAS {1})

Bruceine D is a quassinoid that is 13,20-epoxypicras-3-ene substituted by hydroxy groups at positions 1, 11, 12, 14 and 15 and oxo groups at positions 2 and 16. Isolated from the ethanol extract of the stem of Brucea mollis, it exhibits cytotoxic activity. It has a role as a metabolite, an antineoplastic agent and a plant metabolite. It is a delta-lactone, a secondary alpha-hydroxy ketone, a pentol, an organic heteropentacyclic compound and a quassinoid. It derives from a hydride of a picrasane.

Source: ChEBI

Identity
Molecular formulaC20H26O9
Molecular weight410.4 g/mol
IUPAC name(1R,2R,3R,6R,8S,12S,13S,14R,15R,16S,17R)-2,3,12,15,16-pentahydroxy-9,13,17-trimethyl-5,18-dioxapentacyclo[12.5.0.01,6.02,17.08,13]nonadec-9-ene-4,11-dione
InChIKeyJBDMZGKDLMGOFR-KQSRGDCESA-N
SMILESCC1=CC(=O)[C@H]([C@]2([C@H]1C[C@@H]3[C@]45[C@@H]2[C@H]([C@@H]([C@]([C@@]4([C@H](C(=O)O3)O)O)(OC5)C)O)O)C)O

Computed by PubChem (NCBI)

Synonyms: Bruceine D, Brucein D, BruceineD
Related forms of this compound
(1R,2R,3R,6R,8S,12R,13S,14R,15R,16S,17R)-2,3,12,15,16-pentahydroxy-9,13,17-trimethyl-5,18-dioxapentacyclo[12.5.0.01,6.02,17.08,13]nonadec-9-ene-4,11-dione C20H26O9
Isomers (same molecular formula)
(1R,4R,5R,6S,7R,8R,11R,13S,17S,18S,19R)-4,5,7,8,17-pentahydroxy-6,14,18-trimethyl-3,10-dioxapentacyclo[9.8.0.01,7.04,19.013,18]nonadec-14-ene-9,16-dione C20H26O9
[(3aS,4R,6S,7R,7aS)-7-acetyloxy-6-(4-methoxyphenoxy)-2,2-dimethyl-4,6,7,7a-tetrahydro-3aH-[1,3]dioxolo[4,5-c]pyran-4-yl]methyl acetate C20H26O9
[(2R,3S,4S,5R,6R)-3,5-diacetyloxy-6-methoxy-4-phenylmethoxyoxan-2-yl]methyl acetate C20H26O9
butyl (1S,3R,4R,5R)-3-[(E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy-1,4,5-trihydroxycyclohexane-1-carboxylate C20H26O9
2-[(2R)-2-hydroxypropyl]-7-methoxy-5-methyl-8-[(2S,3R,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]chromen-4-one C20H26O9
(1R,4R,5R,7R,8R,11R,13S,16S,17S,18S,19R)-4,5,7,8,16,17-hexahydroxy-14,18-dimethyl-6-methylidene-3,10-dioxapentacyclo[9.8.0.01,7.04,19.013,18]nonadec-14-en-9-one C20H26O9
(1S,4R,5R,6R,7R,11R,13S,17S,18S,19R)-4,5,6,17-tetrahydroxy-6-(hydroxymethyl)-14,18-dimethyl-3,10-dioxapentacyclo[9.8.0.01,7.04,19.013,18]nonadec-14-ene-9,16-dione C20H26O9

Also listed as

Bruceine D/ 99.99% TargetMol CAS 21499-66-1
Bruceine D Biosynth CAS 21499-66-1
Bruceine D 95% Ambeed CAS 21499-66-1
Bruceine D, 99.50% MedChemExpress CAS 21499-66-1
Bruceine D, 95% Fluorochem CAS 21499-66-1