naled

CHEBI:38729 ·resolve ·ANTIBACTERIAL ·EXACT SEEDED

An dialkyl phosphate resulting from the formal condensation of the acidic hydroxy group of dimethyl hydrogen phosphate with the alcoholic hydroxy group of 1,2-dibromo-2,2-dichloroethanol. An organophosphate insecticide, it is no longer approved for use within the European Union. — ChEBI

Machine-generated and unreviewed. Identity, structure and cross-references come straight from ChEBI's and CARD's own data; no curator has signed off on this record yet.

Classification

Strictly broader compounds or drug classes this molecule belongs to.

CHEBI:16648 CHEBI:16648
CHEBI:25708 CHEBI:25708
CHEBI:36683 CHEBI:36683
CHEBI:37141 CHEBI:37141

Chemical structure

Computed structure properties
Molecular formula	C4H7Br2Cl2O4P
Charge	0
Average mass	380.784 Da
Monoisotopic mass	377.78257 Da
Source	ChEBI
InChIKey	BUYMVQAILCEWRR-UHFFFAOYSA-N

SMILES

COP(=O)(OC)OC(Br)C(Cl)(Cl)Br

InChI

InChI=1S/C4H7Br2Cl2O4P/c1-10-13(9,11-2)12-3(5)4(6,7)8/h3H,1-2H3

Also called

Bromex (BRAND_NAME)— chebi
Dibrom (BRAND_NAME)— chebi
Ortho-Dibrom (BRAND_NAME)— chebi
1,2-dibromo-2,2-dichloroethyl dimethyl phosphate (EXACT_SYNONYM)— chebi
O,O-dimethyl O-2,2-dichloro-1,2-dibromoethyl phosphate (EXACT_SYNONYM)— chebi
O-(1,2-dibromo-2,2-dichloroethyl)-O,O-dimethyl phosphate (EXACT_SYNONYM)— chebi
dimethyl-1,2-dibromo-2,2-dichloroethyl phosphate (EXACT_SYNONYM)— chebi
phosphoric acid, 1,2-dibromo-2,2-dichloroethyl dimethyl ester (EXACT_SYNONYM)— chebi

Cross-references

Equivalent identifiers for this same structure in other resources.

beilstein:2049930
cas:300-76-5
kegg.compound:C18749
patent:GB855157
patent:US2971882
pesticides:naled
ppdb:480
wikipedia.en:Naled

Activity roles

Every antimicrobial role a source asserts for this compound — the unreduced evidence behind its antimicrobial_class.

CHEBI:33282 CHEBI:33282
CHEBI:35718 CHEBI:35718

Source concepts

Every upstream concept that resolved to this record. The merge is the product: this is what shows ChEBI and CARD are describing the same structure.

Upstream concepts merged into this record
Source	Native ID	Label	Minted CURIE	Version
CHEBI	`CHEBI:38729`	naled	`antibioticmech:chebi-f89e83e4a9`	2026-08-30

Curation history

SEEDED_FROM_SOURCES 2026-08-30 · seed_from_sources
Seeded from data/raw/ inventories (CHEBI)
RESEEDED_FROM_SOURCES 2026-08-30 · seed_from_sources
Re-seeded from updated data/raw/ inventories
RESEEDED_FROM_SOURCES 2026-08-30 · seed_from_sources
Re-seeded from updated data/raw/ inventories

Provenance

Seeded by scripts/seed_from_sources.py from the committed inventories in data/raw/. View the record.