Products 21416-53-5

CAS 21416-53-5 appears in our catalog under these names: Picrotin, min. 95 %, 5 g, Picrotin, Picrotin, 95%, Picrotin/ 97.11% (existing batch purity), Picrotin, 97.11% ,, 97.11% ,. Offered by: Roth, GLPBio, Combi-blocks, TargetMol, Biosynth. Available pack sizes: 5g, 5mg, 250mg, 1g, 10mg, 25mg, 50mg, 100mg.

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

Picrotin is an organic heteropentacyclic compound that is picrotoxinin in which the olefinic double bond has undergone addition of water to give the corresponding tertiary alcohol. It is the less toxic component of picrotoxin, lacking GABA activity. It has a role as a plant metabolite. It is a picrotoxane sesquiterpenoid, a diol, a tertiary alcohol, an epoxide, a gamma-lactone and an organic heteropentacyclic compound. It is functionally related to a picrotoxinin.

Source: ChEBI

Identity
Molecular formulaC15H18O7
Molecular weight310.30 g/mol
IUPAC name(1R,3R,5S,8S,9R,12S,13R,14S)-1-hydroxy-14-(2-hydroxypropan-2-yl)-13-methyl-4,7,10-trioxapentacyclo[6.4.1.19,12.03,5.05,13]tetradecane-6,11-dione
InChIKeyRYEFFICCPKWYML-QCGISDTRSA-N
SMILESC[C@@]12[C@H]3[C@H]4[C@H]([C@@H]([C@@]1(C[C@@H]5[C@]2(O5)C(=O)O3)O)C(=O)O4)C(C)(C)O

Computed by PubChem (NCBI)