Products 57-87-4

CAS 57-87-4 appears in our catalog under these names: Ergocalciferol EP Impurity B (Ergosterol), Ergosterol, >95% (HPLC), Ergosterol, Ergosterol (Provitamin D2), Ergosterol/ 99.8% (existing batch purity). Offered by: Chemat Brand, TRC, Mikromol, Dr. Ehrenstorfer, GLPBio. Available pack sizes: on request, 100mg, 10mg, 1g, 25mg, 10mM (in 1ml dmso), 5g, 25g.

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

Ergosterol is a phytosterol consisting of ergostane having double bonds at the 5,6-, 7,8- and 22,23-positions as well as a 3beta-hydroxy group. It has a role as a Saccharomyces cerevisiae metabolite and a fungal metabolite. It is a 3beta-hydroxy-Delta(5)-steroid, a member of phytosterols, a 3beta-sterol and an ergostanoid.

Source: ChEBI

Identity
Molecular formulaC28H44O
Molecular weight396.6 g/mol
IUPAC name(3S,9S,10R,13R,14R,17R)-17-[(E,2R,5R)-5,6-dimethylhept-3-en-2-yl]-10,13-dimethyl-2,3,4,9,11,12,14,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-3-ol
InChIKeyDNVPQKQSNYMLRS-APGDWVJJSA-N
SMILESC[C@H](/C=C/[C@H](C)C(C)C)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3C2=CC=C4[C@@]3(CC[C@@H](C4)O)C)C

Computed by PubChem (NCBI)