allyl alcohol

CHEBI:16605 ·resolve ·ANTIBACTERIAL ·EXACT SEEDED

A propenol in which the C=C bond connects C-2 and C-3. It is has been found in garlic (Allium sativum). Formerly used as a herbicide for the control of various grass and weed seeds. — 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:134394 CHEBI:134394
CHEBI:26300 CHEBI:26300

Chemical structure

Computed structure properties
Molecular formula	C3H6O
Charge	0
Average mass	58.08 Da
Monoisotopic mass	58.04186 Da
Source	ChEBI
InChIKey	XXROGKLTLUQVRX-UHFFFAOYSA-N

SMILES

C=CCO

InChI

InChI=1S/C3H6O/c1-2-3-4/h2,4H,1,3H2

Also called

prop-2-en-1-ol (EXACT_SYNONYM)— chebi
2-Propen-1-ol (EXACT_SYNONYM)— chebi
2-Propenol (EXACT_SYNONYM)— chebi
2-Propenyl alcohol (EXACT_SYNONYM)— chebi
3-Hydroxypropene (EXACT_SYNONYM)— chebi
Allyl alcohol (EXACT_SYNONYM)— chebi
Vinyl carbinol (EXACT_SYNONYM)— chebi
Vinylcarbinol (EXACT_SYNONYM)— chebi

Cross-references

Equivalent identifiers for this same structure in other resources.

cas:107-18-6
hmdb:HMDB0031652
kegg.compound:C02001
metacyc.compound:ALLYL-ALCOHOL
ppdb:2698
reaxys:605307
wikipedia.en:Allyl_alcohol

Activity roles

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

CHEBI:24127 CHEBI:24127
CHEBI:33282 CHEBI:33282

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:16605`	allyl alcohol	`antibioticmech:chebi-984f372723`	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.