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.

Label unavailable CHEBI:16648
Label unavailable CHEBI:25708
Label unavailable CHEBI:36683
Label unavailable 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

Identifiers for this same structure in other resources. An accession that lands on two different structures in this corpus is withheld from both rather than shown here, since it names at most one of them.

Patents and articles

Documents about this compound. A patent covers a class and an article covers a topic; neither identifies a structure.

Activity roles

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

antibacterial agent CHEBI:33282
antifungal agent 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
RESEEDED_FROM_SOURCES 2026-09-10 · 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 (YAML).

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