Products 55576-66-4

CAS 55576-66-4 appears in our catalog under these names: Agrimol B, Agrimol B, Agrimol B/ 99.89% (existing batch purity), Agrimol B 98%, agrimol B, 98%, 98%. Offered by: Chemat Brand, GLPBio, TargetMol, Ambeed, Chemat. Available pack sizes: on request, 10mg, 5mg, 25mg, 50mg, 100mg, 1mg, 250mg.

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

(2S)-1-[3,5-bis[(3-butanoyl-2,6-dihydroxy-4-methoxy-5-methylphenyl)methyl]-2,4,6-trihydroxyphenyl]-2-methylbutan-1-one (CAS 55576-66-4) is a chemical compound with the molecular formula C37H46O12 and a molecular weight of 682.8 g/mol. IUPAC name: (2S)-1-[3,5-bis[(3-butanoyl-2,6-dihydroxy-4-methoxy-5-methylphenyl)methyl]-2,4,6-trihydroxyphenyl]-2-methylbutan-1-one. InChIKey: BVLHMPZMQVWDGX-INIZCTEOSA-N.

Identity
Molecular formulaC37H46O12
Molecular weight682.8 g/mol
IUPAC name(2S)-1-[3,5-bis[(3-butanoyl-2,6-dihydroxy-4-methoxy-5-methylphenyl)methyl]-2,4,6-trihydroxyphenyl]-2-methylbutan-1-one
InChIKeyBVLHMPZMQVWDGX-INIZCTEOSA-N
SMILESCCCC(=O)C1=C(C(=C(C(=C1O)CC2=C(C(=C(C(=C2O)C(=O)[C@@H](C)CC)O)CC3=C(C(=C(C(=C3O)C)OC)C(=O)CCC)O)O)O)C)OC

Computed by PubChem (NCBI)