Aplasmomycin

cas: 61230-25-9 — see every product listed under this CAS number, including other names

Aplasmomycin (CAS 61230-25-9) is a chemical reagent available from Chemat. Available pack sizes: Get quote. Offered by: MedChemExpress.

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catalog numberHY-N15095-Get quote
cas61230-25-9
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Structural formula: {0} (CAS {1})

(+)-aplasmomycin is a macrolide antibiotic and a boron oxoanion.

Source: ChEBI

Identity
Molecular formulaC40H60BNaO14
Molecular weight798.7 g/mol
IUPAC namesodium (1R,2R,5S,6R,8S,9E,12R,14S,17R,18R,22R,25S,26R,28S,29E,32R,34S,37R)-12,32-dihydroxy-6,13,13,17,26,33,33,37-octamethyl-4,7,19,21,24,27,38,39,41,42-decaoxa-20-boranuidaoctacyclo[18.17.1.11,34.12,20.15,8.114,18.125,28.018,22]tritetraconta-9,29-diene-3,23-dione
InChIKeyGEIYDRPAWIMINR-ZDKANEFWSA-N
SMILES[B-]123O[C@]45O[C@H](C([C@@H](C/C=C/[C@H]6O[C@@H]([C@H](C6)OC(=O)[C@H](O1)[C@]7(O2)O[C@H](C([C@@H](C/C=C/[C@H]8O[C@@H]([C@H](C8)OC(=O)[C@@H]4O3)C)O)(C)C)CC[C@H]7C)C)O)(C)C)CC[C@H]5C.[Na+]

Computed by PubChem (NCBI)

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