Products 52949-83-4

CAS 52949-83-4 appears in our catalog under these names: Ajugol/ 99.65% (existing batch purity), Ajugol, Ajugol 98+%, (1S,4aR,5R,7S,7aS)-1,4a,5,6,7,7a-Hexahydro-5,7-dihydroxy-7-methylcyclopenta[c]pyran-1-yl β-D-glucopyranoside, 98%, 98%, Ajugol (Standard). Offered by: TargetMol, GLPBio, Biosynth, Ambeed, Chemat. Available pack sizes: 20mg, 1mg, 10mg, 5mg, 10mM (in 1ml dmso), 25mg, 50mg, Get quote.

Structural formula: {0} (CAS {1})

Ajugol is a glycoside and an iridoid monoterpenoid.

Source: ChEBI

Identity
Molecular formulaC15H24O9
Molecular weight348.34 g/mol
IUPAC name(2S,3R,4S,5S,6R)-2-[[(1S,4aR,5R,7S,7aS)-5,7-dihydroxy-7-methyl-4a,5,6,7a-tetrahydro-1H-cyclopenta[c]pyran-1-yl]oxy]-6-(hydroxymethyl)oxane-3,4,5-triol
InChIKeyVELYAQRXBJLJAK-XKKWFBPMSA-N
SMILESC[C@@]1(C[C@H]([C@H]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

Computed by PubChem (NCBI)