Products 1151862-69-9

CAS 1151862-69-9 is the registry number for Caprarioside. Offered by: GLPBio, Biosynth, MedChemExpress. Available pack sizes: 5mg, 25mg, 1mg, 10mg, 50mg, Get quote.

Caprarioside
GLPBio, Biosynth, MedChemExpress
  • size: 5mg, 25mg, 1mg, 10mg
  • Variants: 7
from 4828.21
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Structural formula: {0} (CAS {1})

[(1S,4aS,5R,7S,7aS)-4a,5-dihydroxy-7-methyl-1-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1,5,6,7a-tetrahydrocyclopenta[c]pyran-7-yl] benzoate (CAS 1151862-69-9) is a chemical compound with the molecular formula C22H28O11 and a molecular weight of 468.4 g/mol. IUPAC name: [(1S,4aS,5R,7S,7aS)-4a,5-dihydroxy-7-methyl-1-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1,5,6,7a-tetrahydrocyclopenta[c]pyran-7-yl] benzoate. InChIKey: SMCDFJHVOYELKQ-UHXGZAEASA-N.

Identity
Molecular formulaC22H28O11
Molecular weight468.4 g/mol
IUPAC name[(1S,4aS,5R,7S,7aS)-4a,5-dihydroxy-7-methyl-1-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1,5,6,7a-tetrahydrocyclopenta[c]pyran-7-yl] benzoate
InChIKeySMCDFJHVOYELKQ-UHXGZAEASA-N
SMILESC[C@@]1(C[C@H]([C@]2([C@@H]1[C@@H](OC=C2)O[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)CO)O)O)O)O)O)OC(=O)C4=CC=CC=C4

Computed by PubChem (NCBI)

Synonyms: Caprarioside, orb1681176
Isomers (same molecular formula)
(2S)-2-(2-hydroxypropan-2-yl)-4-methoxy-7-[[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]-2,3-dihydrofuro[3,2-g]chromen-5-one C22H28O11
(2S,3S,5R,6S)-6-[2-(2-ethyl-5-oxohexoxy)carbonylbenzoyl]oxy-3,4,5-trihydroxyoxane-2-carboxylic acid C22H28O11
(2S)-7-(hydroxymethyl)-4-methoxy-2-[2-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxypropan-2-yl]-2,3-dihydrofuro[3,2-g]chromen-5-one C22H28O11