CAS 1487375-69-8 appears in our catalog under these names: Cereulide–13C6, Cereulide-13C6, 97.0%. Offered by: GLPBio, MedChemExpress. Available pack sizes: 20μg(17,25μM * 1ml in acetonitrile), 20 μg (17.25 μM * 1 mL in Acetonitrile).
(3R,6R,9S,12S,15R,18R,21S,24S,27R,30R,33S,36S)-3,15,27-tri((113C)methyl)-6,18,30-tris(2-methylpropyl)-9,12,21,24,33,36-hexa(propan-2-yl)-1,7,13,19,25,31-hexaoxa-4,10,16,22,28,34-hexazacyclohexatriacontane-2,5,8,11,14,17,20,23,26,29,32,35-dodecone (CAS 1487375-69-8) is a chemical compound with the molecular formula C57H96N6O18 and a molecular weight of 1159.4 g/mol. IUPAC name: (3R,6R,9S,12S,15R,18R,21S,24S,27R,30R,33S,36S)-3,15,27-tri((113C)methyl)-6,18,30-tris(2-methylpropyl)-9,12,21,24,33,36-hexa(propan-2-yl)-1,7,13,19,25,31-hexaoxa-4,10,16,22,28,34-hexazacyclohexatriacontane-2,5,8,11,14,17,20,23,26,29,32,35-dodecone. InChIKey: JWWAHGUHYLWQCQ-NUOMGVRCSA-N.
| Molecular formula | C57H96N6O18 |
|---|---|
| Molecular weight | 1159.4 g/mol |
| IUPAC name | (3R,6R,9S,12S,15R,18R,21S,24S,27R,30R,33S,36S)-3,15,27-tri((113C)methyl)-6,18,30-tris(2-methylpropyl)-9,12,21,24,33,36-hexa(propan-2-yl)-1,7,13,19,25,31-hexaoxa-4,10,16,22,28,34-hexazacyclohexatriacontane-2,5,8,11,14,17,20,23,26,29,32,35-dodecone |
| InChIKey | JWWAHGUHYLWQCQ-NUOMGVRCSA-N |
| SMILES | CC(C)C[C@@H]1C(=O)N[C@@H](C(=O)O[C@H](C(=O)N[C@H]([13C](=O)O[C@@H](C(=O)N[C@@H](C(=O)O[C@H](C(=O)N[C@H]([13C](=O)O[C@@H](C(=O)N[C@@H](C(=O)O[C@H](C(=O)N[C@H]([13C](=O)O1)C(C)C)C(C)C)[13CH3])CC(C)C)C(C)C)C(C)C)[13CH3])CC(C)C)C(C)C)C(C)C)[13CH3] |
Computed by PubChem (NCBI)