Products 827319-50-6

CAS 827319-50-6 is the registry number for Perforatumone. Offered by: GLPBio, Biosynth. Available pack sizes: 1mg, 5mg, 10mg, 25mg, 50mg.

Perforatumone
GLPBio, Biosynth
  • size: 1mg, 5mg, 10mg, 25mg
  • Variants: 6
from 1617.39
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Structural formula: {0} (CAS {1})

4-methyl-1,3,6-tris(3-methylbut-2-enyl)-5-(3-methyl-2-oxobutanoyl)-4-(4-methylpent-3-enyl)-7-oxabicyclo[4.2.1]nonane-8,9-dione (CAS 827319-50-6) is a chemical compound with the molecular formula C35H52O5 and a molecular weight of 552.8 g/mol. IUPAC name: 4-methyl-1,3,6-tris(3-methylbut-2-enyl)-5-(3-methyl-2-oxobutanoyl)-4-(4-methylpent-3-enyl)-7-oxabicyclo[4.2.1]nonane-8,9-dione. InChIKey: MDEFUUIAPRQDDQ-UHFFFAOYSA-N.

Identity
Molecular formulaC35H52O5
Molecular weight552.8 g/mol
IUPAC name4-methyl-1,3,6-tris(3-methylbut-2-enyl)-5-(3-methyl-2-oxobutanoyl)-4-(4-methylpent-3-enyl)-7-oxabicyclo[4.2.1]nonane-8,9-dione
InChIKeyMDEFUUIAPRQDDQ-UHFFFAOYSA-N
SMILESCC(C)C(=O)C(=O)C1C(C(CC2(C(=O)C1(OC2=O)CC=C(C)C)CC=C(C)C)CC=C(C)C)(C)CCC=C(C)C

Computed by PubChem (NCBI)

Synonyms: Perforatumone
Isomers (same molecular formula)
(1R,3R,4R,5S,7R,8S)-8-hydroxy-4-methyl-1,5,7-tris(3-methylbut-2-enyl)-4-(4-methylpent-3-enyl)-3-(2-methylpropanoyl)-9-oxatricyclo[5.2.1.03,8]decane-2,10-dione C35H52O5
(4R,4aS,6aR,6aS,6bR,8aR,12aR,14bS)-2,2,6a,6b,9,9,12a-heptamethyl-4-[(Z)-2-methylbut-2-enoyl]oxy-10-oxo-3,4,5,6,6a,7,8,8a,11,12,13,14b-dodecahydro-1H-picene-4a-carboxylic acid C35H52O5
(4R,4aS,6aR,6aS,6bR,8aR,12aR,14bS)-2,2,6a,6b,9,9,12a-heptamethyl-4-(3-methylbut-2-enoyloxy)-10-oxo-3,4,5,6,6a,7,8,8a,11,12,13,14b-dodecahydro-1H-picene-4a-carboxylic acid C35H52O5