Products 2345732-89-8

CAS 2345732-89-8 appears in our catalog under these names: Glucocorticoid receptor agonist–1 phosphate Ala–Ala–Mal, Glucocorticoid receptor agonist-1 phosphate Ala-Ala-Mal, 98.99%, Glucocorticoid receptor agonist-1 phosphate Ala-Ala-Mal, 95%. Offered by: GLPBio, MedChemExpress, Chemat. Available pack sizes: 5mg, 10 mg, 1 mg, 5 mg, 1mg.

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

[2-[(1S,2S,4R,6R,8S,9S,11S,12S,13R)-6-[4-[[3-[[(2S)-2-[[(2S)-2-[[2-(2,5-dioxopyrrol-1-yl)acetyl]amino]propanoyl]amino]propanoyl]amino]phenyl]methyl]phenyl]-11-hydroxy-9,13-dimethyl-16-oxo-5,7-dioxapentacyclo[10.8.0.02,9.04,8.013,18]icosa-14,17-dien-8-yl]-2-oxoethyl] dihydrogen phosphate (CAS 2345732-89-8) is a chemical compound with the molecular formula C47H53N4O14P and a molecular weight of 928.9 g/mol. IUPAC name: [2-[(1S,2S,4R,6R,8S,9S,11S,12S,13R)-6-[4-[[3-[[(2S)-2-[[(2S)-2-[[2-(2,5-dioxopyrrol-1-yl)acetyl]amino]propanoyl]amino]propanoyl]amino]phenyl]methyl]phenyl]-11-hydroxy-9,13-dimethyl-16-oxo-5,7-dioxapentacyclo[10.8.0.02,9.04,8.013,18]icosa-14,17-dien-8-yl]-2-oxoethyl] dihydrogen phosphate. InChIKey: PCHXBKCIRQOZOP-OWXFDGHLSA-N.

Identity
Molecular formulaC47H53N4O14P
Molecular weight928.9 g/mol
IUPAC name[2-[(1S,2S,4R,6R,8S,9S,11S,12S,13R)-6-[4-[[3-[[(2S)-2-[[(2S)-2-[[2-(2,5-dioxopyrrol-1-yl)acetyl]amino]propanoyl]amino]propanoyl]amino]phenyl]methyl]phenyl]-11-hydroxy-9,13-dimethyl-16-oxo-5,7-dioxapentacyclo[10.8.0.02,9.04,8.013,18]icosa-14,17-dien-8-yl]-2-oxoethyl] dihydrogen phosphate
InChIKeyPCHXBKCIRQOZOP-OWXFDGHLSA-N
SMILESC[C@@H](C(=O)N[C@@H](C)C(=O)NC1=CC=CC(=C1)CC2=CC=C(C=C2)[C@@H]3O[C@@H]4C[C@H]5[C@@H]6CCC7=CC(=O)C=C[C@@]7([C@H]6[C@H](C[C@@]5([C@@]4(O3)C(=O)COP(=O)(O)O)C)O)C)NC(=O)CN8C(=O)C=CC8=O

Computed by PubChem (NCBI)