API reference

Delamanid

CAS number
681492-22-8
Molecular formula
C25H25F3N4O6
Molecular weight
534.5 g/mol
Delamanid — 2D structure
2D structure (PubChem)

About this molecule

Delamanid is a nitro-dihydro-imidazooxazole derivative, with antimycobacterial activity. Upon oral administration, delamanid, a prodrug, is activated via the mycobacterial F420 coenzyme system to form a reactive intermediate metabolite that inhibits the synthesis of the mycobacterial cell wall components methoxy-mycolic and keto-mycolic acid. This leads to the depletion of these cell wall components and destruction of mycobacteria.

Source: NCI Thesaurus (NCIt), via PubChem.

Identifiers

IUPAC name
(2R)-2-methyl-6-nitro-2-[[4-[4-[4-(trifluoromethoxy)phenoxy]piperidin-1-yl]phenoxy]methyl]-3H-imidazo[2,1-b][1,3]oxazole
InChIKey
XDAOLTSRNUSPPH-XMMPIXPASA-N
SMILES
C[C@@]1(CN2C=C(N=C2O1)[N+](=O)[O-])COC3=CC=C(C=C3)N4CCC(CC4)OC5=CC=C(C=C5)OC(F)(F)F
PubChem CID
6480466

Also known as

Delamanid · deltyba · delamanidum · J04AK06 · Deltyba (TN) · Delamanid (Standard) · Delamanid (JAN/USAN)

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