(2S,3S,4S,5R,6S)-3,4,5-Trihydroxy-6-(4-(2-(4-hydroxyphenyl)propan-2-yl)phenoxy)tetrahydro-2H-pyran-2-carboxylic acid, 98%

cas: 267244-08-6 — see every product listed under this CAS number, including other names

(2S,3S,4S,5R,6S)-3,4,5-Trihydroxy-6-(4-(2-(4-hydroxyphenyl)propan-2-yl)phenoxy)tetrahydro-2H-pyran-2-carboxylic acid, 98% (CAS 267244-08-6) is a chemical reagent available from Chemat. Available pack sizes: 25mg, 50mg, 100mg. Offered by: BLDpharm, Chemat, Fluorochem.

• 2D
• 3D

(2S,3S,4S,5R,6S)-3,4,5-trihydroxy-6-[4-[2-(4-hydroxyphenyl)propan-2-yl]phenoxy]oxane-2-carboxylic acid (CAS 267244-08-6) is a chemical compound with the molecular formula C21H24O8 and a molecular weight of 404.4 g/mol. IUPAC name: (2S,3S,4S,5R,6S)-3,4,5-trihydroxy-6-[4-[2-(4-hydroxyphenyl)propan-2-yl]phenoxy]oxane-2-carboxylic acid. InChIKey: KHZOXXYQSBJDHB-HBWRTXEVSA-N.

Identity

Molecular formula	C21H24O8
Molecular weight	404.4 g/mol
IUPAC name	(2S,3S,4S,5R,6S)-3,4,5-trihydroxy-6-[4-[2-(4-hydroxyphenyl)propan-2-yl]phenoxy]oxane-2-carboxylic acid
InChIKey	KHZOXXYQSBJDHB-HBWRTXEVSA-N
SMILES	CC(C)(C1=CC=C(C=C1)O)C2=CC=C(C=C2)O[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)C(=O)O)O)O)O

Computed by PubChem (NCBI)

Synonyms: bisphenol A glucuronide, BPA-gluc, BPA-monoglucuronide, Bisphenol A b-D-Glucuronide, Bisphenol A beta-D-Glucuronide, Bisphenol A-|A-D-glucuronide, Bisphenol A-?-D-Glucuronide, Bisphenol A |A-D-Glucuronide, starbld0018869, Bisphenol-beta-D-Glucuronide

Related forms of this compound

(2S,3S,4S,5R,6S)-3,4,5-trihydroxy-6-[4-[2-(4-hydroxy(1,2,3,4,5,6-13C6)cyclohexa-1,3,5-trien-1-yl)propan-2-yl](1,2,3,4,5,6-13C6)cyclohexa-1,3,5-trien-1-yl]oxyoxane-2-carboxylic acid C₂₁H₂₄O₈

(2S,3S,4S,5R,6S)-6-[4-[1,1,1,3,3,3-hexadeuterio-2-(4-hydroxyphenyl)propan-2-yl]phenoxy]-3,4,5-trihydroxyoxane-2-carboxylic acid C₂₁H₂₄O₈

Isomers (same molecular formula)

(2S,3R,4S,5S,6R)-2-[3-hydroxy-5-[(E)-2-(4-methoxyphenyl)ethenyl]phenoxy]-6-(hydroxymethyl)oxane-3,4,5-triol C₂₁H₂₄O₈

methyl 3-methoxy-4-[3-(2-methoxy-4-methoxycarbonylphenoxy)propoxy]benzoate C₂₁H₂₄O₈

2-acetyl-4-[(5-acetyl-2,6-dihydroxy-3,3-dimethyl-4-oxocyclohexa-1,5-dien-1-yl)methyl]-3,5-dihydroxy-6,6-dimethylcyclohexa-2,4-dien-1-one C₂₁H₂₄O₈

4-[(2R,3R)-3-(hydroxymethyl)-7-[(E)-3-hydroxyprop-1-enyl]-5-methoxy-2,3-dihydro-1,4-benzodioxin-2-yl]-2,6-dimethoxyphenol C₂₁H₂₄O₈

(2S,3R,4S,5S,6R)-2-[4-[(E)-2-(3-hydroxy-5-methoxyphenyl)ethenyl]phenoxy]-6-(hydroxymethyl)oxane-3,4,5-triol C₂₁H₂₄O₈

[5-acetyloxy-6-formyl-10-(hydroxymethyl)-3-methylidene-2-oxo-3a,4,5,8,9,11a-hexahydrocyclodeca[b]furan-4-yl] 2-methylprop-2-enoate C₂₁H₂₄O₈