Products 78111-17-8

CAS 78111-17-8 appears in our catalog under these names: Okadaic Acid, >95% (HPLC), Okadaic acid, Okadaic acid, 98% , Okadaic acid, 97.00%, Okadaic acid. Offered by: TRC, GLPBio, Thermo Scientific (Alfa Aesar), Chemat, Biosynth. Available pack sizes: 1mg, 50μg, 100μg, 100microg, 300microg, 50microgram, 100ug, 25ug.

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

Okadaic acid is a polycyclic ether that is produced by several species of dinoflagellates, and is known to accumulate in both marine sponges and shellfish. A polyketide, polyether derivative of a C38 fatty acid, it is one of the primary causes of diarrhetic shellfish poisoning (DSP). It is a potent inhibitor of specific protein phosphatases and is known to have a variety of negative effects on cells. It has a role as a calcium ionophore, an EC 3.1.3.16 (phosphoprotein phosphatase) inhibitor and a marine metabolite.

Source: ChEBI

Identity
Molecular formulaC44H68O13
Molecular weight805.0 g/mol
IUPAC name(2R)-3-[(2S,6R,8S,11R)-2-[(E,2R)-4-[(2S,2'R,4R,4aS,6R,8aR)-4-hydroxy-2-[(1S,3S)-1-hydroxy-3-[(2S,3R,6S)-3-methyl-1,7-dioxaspiro[5.5]undecan-2-yl]butyl]-3-methylidenespiro[4a,7,8,8a-tetrahydro-4H-pyrano[3,2-b]pyran-6,5'-oxolane]-2'-yl]but-3-en-2-yl]-11-hydroxy-4-methyl-1,7-dioxaspiro[5.5]undec-4-en-8-yl]-2-hydroxy-2-methylpropanoic acid
InChIKeyQNDVLZJODHBUFM-WFXQOWMNSA-N
SMILESC[C@@H]1CC[C@]2(CCCCO2)O[C@@H]1[C@@H](C)C[C@@H]([C@@H]3C(=C)[C@H]([C@H]4[C@H](O3)CC[C@]5(O4)CC[C@@H](O5)/C=C/[C@@H](C)[C@@H]6CC(=C[C@@]7(O6)[C@@H](CC[C@H](O7)C[C@](C)(C(=O)O)O)O)C)O)O

Computed by PubChem (NCBI)