3,5,9-Trihydroxyergosta-7,22-dien-6-one

cas: 88191-14-4 — see every product listed under this CAS number, including other names

3,5,9-Trihydroxyergosta-7,22-dien-6-one (CAS 88191-14-4) is a chemical reagent available from Chemat. Available pack sizes: 5mg, 1mg, 10mg. Offered by: Biosynth.

brandBiosynth
catalog numberFT42620-5mg
cas88191-14-4
size5mg
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properties

categoryControlled Products
purityNo data
delivery time3-4 Weeks
Structural formula: {0} (CAS {1})

(22E,24R)-3beta,5alpha,9alpha-trihydroxyergosta-7,22-dien-6-one is an ergostanoid that is (22E)-ergosta-7,22-diene substituted by hydroxy groups at positions 3, 5 and 9 and an oxo group at position 6 (the 3beta,5alpha stereoisomer). It has been isolated from Aspergillus ochraceus. It has a role as an Aspergillus metabolite. It is a tertiary alpha-hydroxy ketone, a 3beta-hydroxy steroid, a 6-oxo steroid, a 5alpha-hydroxy steroid, an ergostanoid and a 9-hydroxy steroid.

Source: ChEBI

Identity
Molecular formulaC28H44O4
Molecular weight444.6 g/mol
IUPAC name(3S,5R,9R,10R,13R,14R,17R)-17-[(E,2R,5R)-5,6-dimethylhept-3-en-2-yl]-3,5,9-trihydroxy-10,13-dimethyl-1,2,3,4,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-6-one
InChIKeyGUERPVMWCQXYEU-IHEPTZRRSA-N
SMILESC[C@H](/C=C/[C@H](C)C(C)C)[C@H]1CC[C@@H]2[C@@]1(CC[C@]3(C2=CC(=O)[C@@]4([C@@]3(CC[C@@H](C4)O)C)O)O)C

Computed by PubChem (NCBI)