1-dodecylguanidine acetate

CHEBI:74889 ·resolve ·ANTIBACTERIAL ·EXACT SEEDED

An acetate salt resulting from the reaction of equimolar amounts of 1-dodecylguanidine and acetic acid. It is used as a fungicide to control black spot and foliar diseases on apples, pears, peaches, nectarines and strawberries. — 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:59230 CHEBI:59230
CHEBI:86417 CHEBI:86417

Chemical structure

Computed structure properties
Molecular formula	C13H29N3.C2H4O2
Charge	0
Average mass	287.448 Da
Monoisotopic mass	287.25728 Da
Source	ChEBI
InChIKey	YIKWKLYQRFRGPM-UHFFFAOYSA-N

SMILES

CC(=O)O.CCCCCCCCCCCCNC(=N)N

InChI

InChI=1S/C13H29N3.C2H4O2/c1-2-3-4-5-6-7-8-9-10-11-12-16-13(14)15;1-2(3)4/h2-12H2,1H3,(H4,14,15,16);1H3,(H,3,4)

Also called

(dodecylamino)(imino)methanaminium acetate (EXACT_SYNONYM)— chebi
1-dodecylguanidinium acetate (EXACT_SYNONYM)— chebi
N-Dodecylguanidineacetat (EXACT_SYNONYM)— chebi
aceto de N-dodecilguanidina (EXACT_SYNONYM)— chebi
amino(dodecylamino)methaniminium acetate (EXACT_SYNONYM)— chebi
dodecylguanidine acetate (EXACT_SYNONYM)— chebi
dodecylguanidine monoacetate (EXACT_SYNONYM)— chebi
dodine (EXACT_SYNONYM)— chebi
dodine acetate (EXACT_SYNONYM)— chebi
laurylguanidine acetate (EXACT_SYNONYM)— chebi
n-dodecylguanidine acetate (EXACT_SYNONYM)— chebi
n-dodecylguanidine monoacetate (EXACT_SYNONYM)— chebi
n-dodecylguanidinium acetate (EXACT_SYNONYM)— chebi
n-dodecylguanidinium monoacetate (EXACT_SYNONYM)— chebi

Cross-references

Equivalent identifiers for this same structure in other resources.

cas:2439-10-3
kegg.compound:C18723
patent:US2867562
patent:US2921881
pesticides:dodine
ppdb:263
reaxys:6546960

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
CHEBI:86328 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
CHEBI	`CHEBI:74889`	1-dodecylguanidine acetate	`antibioticmech:chebi-ebebb7bbfb`	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.