Products 65247-28-1

CAS 65247-28-1 appears in our catalog under these names: Arvenin II, Arvenin II, 95.11%. Offered by: GLPBio, MedChemExpress. Available pack sizes: 1mg, 1 mg.

Arvenin II
GLPBio
  • size: 1mg
  • Variants: 1
from 2015.23
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Arvenin II, 95.11%
MedChemExpress
  • size: 1 mg
  • Variants: 1
from 1917.23
View product
Structural formula: {0} (CAS {1})

[(6R)-6-hydroxy-6-[(2S,8S,9R,10R,13R,14S,16R,17R)-16-hydroxy-4,4,9,13,14-pentamethyl-3,11-dioxo-2-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-2,7,8,10,12,15,16,17-octahydro-1H-cyclopenta[a]phenanthren-17-yl]-2-methyl-5-oxoheptan-2-yl] acetate (CAS 65247-28-1) is a chemical compound with the molecular formula C38H58O13 and a molecular weight of 722.9 g/mol. IUPAC name: [(6R)-6-hydroxy-6-[(2S,8S,9R,10R,13R,14S,16R,17R)-16-hydroxy-4,4,9,13,14-pentamethyl-3,11-dioxo-2-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-2,7,8,10,12,15,16,17-octahydro-1H-cyclopenta[a]phenanthren-17-yl]-2-methyl-5-oxoheptan-2-yl] acetate. InChIKey: KSENPDOZJGRJHR-GPWVBDSWSA-N.

Identity
Molecular formulaC38H58O13
Molecular weight722.9 g/mol
IUPAC name[(6R)-6-hydroxy-6-[(2S,8S,9R,10R,13R,14S,16R,17R)-16-hydroxy-4,4,9,13,14-pentamethyl-3,11-dioxo-2-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-2,7,8,10,12,15,16,17-octahydro-1H-cyclopenta[a]phenanthren-17-yl]-2-methyl-5-oxoheptan-2-yl] acetate
InChIKeyKSENPDOZJGRJHR-GPWVBDSWSA-N
SMILESCC(=O)OC(C)(C)CCC(=O)[C@@](C)([C@H]1[C@@H](C[C@@]2([C@@]1(CC(=O)[C@@]3([C@H]2CC=C4[C@H]3C[C@@H](C(=O)C4(C)C)O[C@H]5[C@@H]([C@H]([C@@H]([C@H](O5)CO)O)O)O)C)C)C)O)O

Computed by PubChem (NCBI)

Synonyms: Arvenin II, 23,24-dihydrocucurbitacin B 2-O-beta-D-glucoside, orb1984228
Isomers (same molecular formula)
[(E,6R)-6-[(2S,3S,8S,9R,10R,13R,14S,16R,17R)-3,16-dihydroxy-4,4,9,13,14-pentamethyl-11-oxo-2-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1,2,3,7,8,10,12,15,16,17-decahydrocyclopenta[a]phenanthren-17-yl]-6-hydroxy-2-methyl-5-oxohept-3-en-2-yl] acetate C38H58O13