Ajugamacrin, ≥95%

cas: 123313-59-7 — see every product listed under this CAS number, including other names

Ajugamacrin, ≥95% (CAS 123313-59-7) is a chemical reagent available from Chemat. Available pack sizes: 10mg. Offered by: Chemat.

brandChemat
catalog numberCh12V79V-10mg
cas123313-59-7
size10mg
availability 0.01g
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Available pack sizes

brand size price
Chemat 10mg 3021.20 Pln

properties

purity≥95%
delivery time3 weeks
Structural formula: {0} (CAS {1})

[(1S)-2-[(1S,2R,4S,4aR,5R,8R,8aR)-4,8-diacetyloxy-4a-(acetyloxymethyl)-1,2-dimethylspiro[3,4,6,7,8,8a-hexahydro-2H-naphthalene-5,2'-oxirane]-1-yl]-1-(5-oxo-2H-furan-3-yl)ethyl] (2S)-2-methylbutanoate (CAS 123313-59-7) is a chemical compound with the molecular formula C31H44O11 and a molecular weight of 592.7 g/mol. IUPAC name: [(1S)-2-[(1S,2R,4S,4aR,5R,8R,8aR)-4,8-diacetyloxy-4a-(acetyloxymethyl)-1,2-dimethylspiro[3,4,6,7,8,8a-hexahydro-2H-naphthalene-5,2'-oxirane]-1-yl]-1-(5-oxo-2H-furan-3-yl)ethyl] (2S)-2-methylbutanoate. InChIKey: JPFTWOXTEMZXOG-JKZOSZDYSA-N.

Identity
Molecular formulaC31H44O11
Molecular weight592.7 g/mol
IUPAC name[(1S)-2-[(1S,2R,4S,4aR,5R,8R,8aR)-4,8-diacetyloxy-4a-(acetyloxymethyl)-1,2-dimethylspiro[3,4,6,7,8,8a-hexahydro-2H-naphthalene-5,2'-oxirane]-1-yl]-1-(5-oxo-2H-furan-3-yl)ethyl] (2S)-2-methylbutanoate
InChIKeyJPFTWOXTEMZXOG-JKZOSZDYSA-N
SMILESCC[C@H](C)C(=O)O[C@@H](C[C@]1([C@@H](C[C@@H]([C@@]2([C@@H]1[C@@H](CC[C@]23CO3)OC(=O)C)COC(=O)C)OC(=O)C)C)C)C4=CC(=O)OC4

Computed by PubChem (NCBI)