diethofencarb

CHEBI:4520 ·resolve ·ANTIFUNGAL ·EXACT SEEDED

A carbamate ester that is the isopropyl ester of (3,4-diethoxyphenyl)carbamic acid. A fungicide with strong activity against Botrytis cinerea and benzimidazole-resistant strains of Botryis spp. — 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

carbamate fungicidesARO:3009323

Strictly broader compounds or drug classes this molecule belongs to.

Label unavailable CHEBI:23003
Label unavailable CHEBI:35618
carbanilate fungicide CHEBI:87066
carbamate fungicides ARO:3009323

Chemical structure

Computed structure properties
Molecular formula	C14H21NO4
Charge	0
Average mass	267.325 Da
Monoisotopic mass	267.14706 Da
Source	ChEBI
InChIKey	LNJNFVJKDJYTEU-UHFFFAOYSA-N

SMILES

CCOc1ccc(NC(=O)OC(C)C)cc1OCC

InChI

InChI=1S/C14H21NO4/c1-5-17-12-8-7-11(9-13(12)18-6-2)15-14(16)19-10(3)4/h7-10H,5-6H2,1-4H3,(H,15,16)

Also called

propan-2-yl (3,4-diethoxyphenyl)carbamate (EXACT_SYNONYM)— chebi
1-Methylethyl (3,4-diethoxyphenyl)carbamate (EXACT_SYNONYM)— chebi
1-methylethyl N-(3,4-diethoxyphenyl)carbamate (EXACT_SYNONYM)— chebi
Isopropyl 3,4-diethoxycarbanilate (EXACT_SYNONYM)— chebi
isopropyl (3,4-diethoxyphenyl)carbamate (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.

Activity roles

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

fungicide CHEBI:24127
antifungal agrochemical CHEBI:86328

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
ARO	`ARO:3009179`	diethofencarb	`antibioticmech:aro-03e17c5a12`	2026-08-30
CHEBI	`CHEBI:4520`	diethofencarb	`antibioticmech:chebi-414cb8d95c`	2026-08-30

Resistance mechanisms

1 source-backed resistance determinants or associations, with ARO grounding where reported. Grouped by reported mechanism type.

ANTIBIOTIC_TARGET_ALTERATION 1

ANTIBIOTIC_TARGET_ALTERATION
Determinant	ARO ID	Organism	Gene families	Evidence
botrytis cinerea beta-tubulin with mutations conferring resistance against diethofencarb	ARO:3009324	not organism-specific	—	ARO:3009324 (CARD/ARO asserts confers_resistance_to_antibiotic ARO:3009179 (diethofencarb); database assertion, not a primary citation.)

Curation history

SEEDED_FROM_SOURCES 2026-08-30 · seed_from_sources
Seeded from data/raw/ inventories (ARO, 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 (YAML).

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