Products 3604-87-3

CAS 3604-87-3 appears in our catalog under these names: Alpha-Ecdysone ( >90%), a-Ecdysone ( >90%), α–Ecdysone, Ecdysone/ 100%, a-Ecdysone. Offered by: TRC, GLPBio, TargetMol, Biosynth, Chemat. Available pack sizes: 0,5mg, 1mg, 2,5mg, 10mg, 25mg, 5mg, 1 mg, 5 mg.

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

Ecdysone is a 6-oxo steroid that is 5beta-cholest-7-en-6-one substituted by hydroxy groups at positions 2, 3, 14, 22 and 25 respectively (the 2beta, 3beta, 22R stereoisomer). It is a steroid prohormone of the major insect moulting hormone 20-hydroxyecdysone. It has a role as a prohormone. It is an ecdysteroid, a 3beta-sterol, a 2beta-hydroxy steroid, a 14alpha-hydroxy steroid, a 22-hydroxy steroid, a 25-hydroxy steroid and a 6-oxo steroid. It derives from a hydride of a 5beta-cholestane.

Source: ChEBI

Identity
Molecular formulaC27H44O6
Molecular weight464.6 g/mol
IUPAC name(2S,3R,5R,9R,10R,13R,14S,17R)-17-[(2S,3R)-3,6-dihydroxy-6-methylheptan-2-yl]-2,3,14-trihydroxy-10,13-dimethyl-2,3,4,5,9,11,12,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-6-one
InChIKeyUPEZCKBFRMILAV-JMZLNJERSA-N
SMILESC[C@@H]([C@H]1CC[C@@]2([C@@]1(CC[C@H]3C2=CC(=O)[C@H]4[C@@]3(C[C@@H]([C@@H](C4)O)O)C)C)O)[C@@H](CCC(C)(C)O)O

Computed by PubChem (NCBI)