Products 82145-55-9

CAS 82145-55-9 appears in our catalog under these names: 2'- O -Acetylthevetin B, ≥98%, ≥98%, 2'-epi-2'-O-Acetylthevetin B. Offered by: Chemat, MedChemExpress. Available pack sizes: 5mg, 5 mg, 1 mg.

2'- O -Acetylthevetin B, ≥98%, ≥98%
Chemat
  • size: 5mg
  • Variants: 1
from 4494.80
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2'-epi-2'-O-Acetylthevetin B
MedChemExpress
  • size: 5 mg, 1 mg
  • Variants: 2
from 5395.58
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Structural formula: {0} (CAS {1})

[2-[[14-hydroxy-10,13-dimethyl-17-(5-oxo-2H-furan-3-yl)-1,2,3,4,5,6,7,8,9,11,12,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-yl]oxy]-4-methoxy-6-methyl-5-[3,4,5-trihydroxy-6-[[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxan-2-yl]oxyoxan-3-yl] acetate (CAS 82145-55-9) is a chemical compound with the molecular formula C44H68O19 and a molecular weight of 901.0 g/mol. IUPAC name: [2-[[14-hydroxy-10,13-dimethyl-17-(5-oxo-2H-furan-3-yl)-1,2,3,4,5,6,7,8,9,11,12,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-yl]oxy]-4-methoxy-6-methyl-5-[3,4,5-trihydroxy-6-[[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxan-2-yl]oxyoxan-3-yl] acetate. InChIKey: ILSCMGXPNCDKNU-UHFFFAOYSA-N.

Identity
Molecular formulaC44H68O19
Molecular weight901.0 g/mol
IUPAC name[2-[[14-hydroxy-10,13-dimethyl-17-(5-oxo-2H-furan-3-yl)-1,2,3,4,5,6,7,8,9,11,12,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-yl]oxy]-4-methoxy-6-methyl-5-[3,4,5-trihydroxy-6-[[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxan-2-yl]oxyoxan-3-yl] acetate
InChIKeyILSCMGXPNCDKNU-UHFFFAOYSA-N
SMILESCC1C(C(C(C(O1)OC2CCC3(C(C2)CCC4C3CCC5(C4(CCC5C6=CC(=O)OC6)O)C)C)OC(=O)C)OC)OC7C(C(C(C(O7)COC8C(C(C(C(O8)CO)O)O)O)O)O)O

Computed by PubChem (NCBI)

Synonyms: Acetylthevetin B, Thevetin B monoacetate