Products 75747-14-7

CAS 75747-14-7 appears in our catalog under these names: 17-Allylamino-17-Demethoxygeldanamycin, 17-(Allylamino) Geldanamycin, >95% (HPLC), 17–AAG (KOS953), Tanespimycin/ 99.83% (existing batch purity), 17-(Allylamino)-17-demethoxygeldanamycin, 99% . Offered by: Chemat Brand, TRC, GLPBio, TargetMol, Thermo Scientific (Alfa Aesar). Available pack sizes: on request, 100mg, 10mg, 25mg, 200mg, 10mM (in 1ml dmso), 50mg, 5mg.

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

Tanespimycin is a 19-membered macrocyle that is geldanamycin in which the methoxy substituent attached to the benzoquinone moiety has been replaced by an allylamino group. It is a potent inhibitor of heat shock protein 90 (Hsp90). A less toxic analogue than geldanamycin, it induces apoptosis and displays antitumour effects. It has a role as an antineoplastic agent, a Hsp90 inhibitor and an apoptosis inducer. It is a member of 1,4-benzoquinones, an ansamycin, a carbamate ester, an organic heterobicyclic compound and a secondary amino compound. It is functionally related to a geldanamycin.

Source: ChEBI

Identity
Molecular formulaC31H43N3O8
Molecular weight585.7 g/mol
IUPAC name[(4E,6Z,8S,9S,10E,12S,13R,14S,16R)-13-hydroxy-8,14-dimethoxy-4,10,12,16-tetramethyl-3,20,22-trioxo-19-(prop-2-enylamino)-2-azabicyclo[16.3.1]docosa-1(21),4,6,10,18-pentaen-9-yl] carbamate
InChIKeyAYUNIORJHRXIBJ-TXHRRWQRSA-N
SMILESC[C@H]1C[C@@H]([C@@H]([C@H](/C=C(/[C@@H]([C@H](/C=C\C=C(\C(=O)NC2=CC(=O)C(=C(C1)C2=O)NCC=C)/C)OC)OC(=O)N)\C)C)O)OC

Computed by PubChem (NCBI)