Products 112747-98-5

CAS 112747-98-5 appears in our catalog under these names: Clemastanin B, Clemastanin B, Clemastanin B, 99.71%, 4-[(2S,3R,4R)-4-[[4-(β-D-Glucopyranosyloxy)-3-methoxyphenyl]methyl]tetrahydro-3-(hydroxymethyl)-2-furanyl]-2-methoxyphenyl β-D-glucopyranoside, 98%. Offered by: GLPBio, Biosynth, MedChemExpress, Chemat, Sigma-Aldrich. Available pack sizes: 5mg, 1mg, 25mg, 10mg, 50mg, 5 mg, 1 mg.

Clemastanin B
GLPBio
  • size: 5mg, 1mg
  • Variants: 2
from 985.52
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Clemastanin B
Biosynth, Sigma-Aldrich
  • size: 25mg, 10mg, 50mg, 1MG
  • Variants: 4
from 2118.00
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Clemastanin B, 99.71%
MedChemExpress
  • size: 5 mg, 1 mg
  • Variants: 2
from 839.82
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4-[(2S,3R,4R)-4-[[4-(β-D-Glucopyranosyloxy)-3-methoxyphenyl]methyl]tetrahydro-3-(hydroxymethyl)-2-furanyl]-2-methoxyphenyl β-D-glucopyranoside, 98%
Chemat
  • size: 1mg
  • Variants: 1
from 750.80
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Structural formula: {0} (CAS {1})

(2R,3S,4S,5R,6S)-2-(hydroxymethyl)-6-[4-[[(3R,4R,5S)-4-(hydroxymethyl)-5-[3-methoxy-4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]oxolan-3-yl]methyl]-2-methoxyphenoxy]oxane-3,4,5-triol (CAS 112747-98-5) is a chemical compound with the molecular formula C32H44O16 and a molecular weight of 684.7 g/mol. IUPAC name: (2R,3S,4S,5R,6S)-2-(hydroxymethyl)-6-[4-[[(3R,4R,5S)-4-(hydroxymethyl)-5-[3-methoxy-4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]oxolan-3-yl]methyl]-2-methoxyphenoxy]oxane-3,4,5-triol. InChIKey: PBLWZMSRSJTRHJ-NCIRKIHRSA-N.

Identity
Molecular formulaC32H44O16
Molecular weight684.7 g/mol
IUPAC name(2R,3S,4S,5R,6S)-2-(hydroxymethyl)-6-[4-[[(3R,4R,5S)-4-(hydroxymethyl)-5-[3-methoxy-4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]oxolan-3-yl]methyl]-2-methoxyphenoxy]oxane-3,4,5-triol
InChIKeyPBLWZMSRSJTRHJ-NCIRKIHRSA-N
SMILESCOC1=C(C=CC(=C1)C[C@H]2CO[C@@H]([C@H]2CO)C3=CC(=C(C=C3)O[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO)O)O)O)OC)O[C@H]5[C@@H]([C@H]([C@@H]([C@H](O5)CO)O)O)O

Computed by PubChem (NCBI)

Synonyms: Clemastanin B, Lariciresinol diglucoside, orb1684693, (+)-lariciresinol-di-4-O-beta-D-glucopranoside, LAriciresinol 4,4'-bis-O-|A-D-glucopyranoside, lariciresinol-4,4'-bis-O-beta-D-glucopyranoside
Isomers (same molecular formula)
methyl (1R,2S,3R,6R,8S,9S,13S,14R,15R,16S,17R)-15,16-dihydroxy-9,13-dimethyl-3-(3-methylbutanoyloxy)-4,10-dioxo-11-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-5,18-dioxapentacyclo[12.5.0.01,6.02,17.08,13]nonadec-11-ene-17-carboxylate C32H44O16
(2R,3S,4S,5R,6R)-2-(hydroxymethyl)-6-[[(2R,3S,4S,5R,6S)-3,4,5-trihydroxy-6-[4-[(2S,3R,4R)-4-[(4-hydroxy-3-methoxyphenyl)methyl]-3-(hydroxymethyl)oxolan-2-yl]-2-methoxyphenoxy]oxan-2-yl]methoxy]oxane-3,4,5-triol C32H44O16