1-((3S,4R)-3-([1,1'-Biphenyl]-4-ylmethyl)-4-hydroxychroman-7-yl)cyclopentane-1-carboxylic acid, 98%

cas: 158081-99-3 — see every product listed under this CAS number, including other names

1-((3S,4R)-3-([1,1'-Biphenyl]-4-ylmethyl)-4-hydroxychroman-7-yl)cyclopentane-1-carboxylic acid, 98% (CAS 158081-99-3) is a chemical reagent available from Chemat. Available pack sizes: 5mg, 10mg, 25mg, 50mg. Offered by: BLDpharm.

• 2D
• 3D

1-[(3S,4R)-4-hydroxy-3-[(4-phenylphenyl)methyl]-3,4-dihydro-2H-chromen-7-yl]cyclopentane-1-carboxylic acid (CAS 158081-99-3) is a chemical compound with the molecular formula C28H28O4 and a molecular weight of 428.5 g/mol. IUPAC name: 1-[(3S,4R)-4-hydroxy-3-[(4-phenylphenyl)methyl]-3,4-dihydro-2H-chromen-7-yl]cyclopentane-1-carboxylic acid. InChIKey: KMNLXCBYBKHKSK-BKMJKUGQSA-N.

Identity

Molecular formula	C28H28O4
Molecular weight	428.5 g/mol
IUPAC name	1-[(3S,4R)-4-hydroxy-3-[(4-phenylphenyl)methyl]-3,4-dihydro-2H-chromen-7-yl]cyclopentane-1-carboxylic acid
InChIKey	KMNLXCBYBKHKSK-BKMJKUGQSA-N
SMILES	C1CCC(C1)(C2=CC3=C(C=C2)[C@@H]([C@H](CO3)CC4=CC=C(C=C4)C5=CC=CC=C5)O)C(=O)O

Computed by PubChem (NCBI)

Synonyms: Pfizer 105696, Tox21_300468, orb1707431, orb2901615

Isomers (same molecular formula)

1-[(4S,5S)-5-ethenyl-2,2-dimethyl-1,3-dioxolan-4-yl]-2-trityloxyethanone C₂₈H₂₈O₄

6-[3-(3-hydroxy-1-adamantyl)-4-methoxyphenyl]naphthalene-2-carboxylic acid C₂₈H₂₈O₄

(3aS,4R,6aS)-2,2-dimethyl-4-(trityloxymethyl)-3a,6a-dihydrocyclopenta[d][1,3]dioxol-4-ol C₂₈H₂₈O₄