FXR antagonist 1

cas: 2295804-68-9 — see every product listed under this CAS number, including other names

FXR antagonist 1 (CAS 2295804-68-9) is a chemical reagent available from Chemat. Available pack sizes: 1mg. Offered by: GLPBio.

brandGLPBio
catalog numberGC71156-1
cas2295804-68-9
size1mg
Need more information?

Ask us about this product — we're happy to help.

Available pack sizes

brand size price
GLPBio 1mg 1509.74 Pln

properties

purityNo data
delivery timeTo be confirmed by Chemat
Structural formula: {0} (CAS {1})

2-[[(1S,3aS,5aR,5bR,7aR,9R,11aR,11bR,13aR,13bR)-9-butanoyloxy-5a,5b,8,8,11a-pentamethyl-1-propan-2-yl-1,2,3,4,5,6,7,7a,9,10,11,11b,12,13,13a,13b-hexadecahydrocyclopenta[a]chrysene-3a-carbonyl]amino]acetic acid (CAS 2295804-68-9) is a chemical compound with the molecular formula C36H59NO5 and a molecular weight of 585.9 g/mol. IUPAC name: 2-[[(1S,3aS,5aR,5bR,7aR,9R,11aR,11bR,13aR,13bR)-9-butanoyloxy-5a,5b,8,8,11a-pentamethyl-1-propan-2-yl-1,2,3,4,5,6,7,7a,9,10,11,11b,12,13,13a,13b-hexadecahydrocyclopenta[a]chrysene-3a-carbonyl]amino]acetic acid. InChIKey: CLKCLHBPLVDIOB-VCXUAKCGSA-N.

Identity
Molecular formulaC36H59NO5
Molecular weight585.9 g/mol
IUPAC name2-[[(1S,3aS,5aR,5bR,7aR,9R,11aR,11bR,13aR,13bR)-9-butanoyloxy-5a,5b,8,8,11a-pentamethyl-1-propan-2-yl-1,2,3,4,5,6,7,7a,9,10,11,11b,12,13,13a,13b-hexadecahydrocyclopenta[a]chrysene-3a-carbonyl]amino]acetic acid
InChIKeyCLKCLHBPLVDIOB-VCXUAKCGSA-N
SMILESCCCC(=O)O[C@@H]1CC[C@@]2([C@H]3CC[C@@H]4[C@H]5[C@@H](CC[C@@]5(CC[C@]4([C@@]3(CC[C@H]2C1(C)C)C)C)C(=O)NCC(=O)O)C(C)C)C

Computed by PubChem (NCBI)

Synonyms: FXR antagonist 1, orb1685896

Also listed as

FXR antagonist 1, 98.01% MedChemExpress CAS 2295804-68-9