coniferyl aldehyde

CHEBI:16547 ·resolve ·ANTIFUNGAL ·EXACT SEEDED

A member of the class of cinnamaldehydes that is cinnamaldehyde substituted by a hydroxy group at position 4 and a methoxy group at position 3. — 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:134251 CHEBI:134251
CHEBI:23245 CHEBI:23245
CHEBI:26004 CHEBI:26004

Chemical structure

Computed structure properties
Molecular formula	C10H10O3
Charge	0
Average mass	178.187 Da
Monoisotopic mass	178.06299 Da
Source	ChEBI
InChIKey	DKZBBWMURDFHNE-NSCUHMNNSA-N

SMILES

COc1cc(/C=C/C=O)ccc1O

InChI

InChI=1S/C10H10O3/c1-13-10-7-8(3-2-6-11)4-5-9(10)12/h2-7,12H,1H3/b3-2+

Also called

3-(4-hydroxy-3-methoxyphenyl)prop-2-enal (EXACT_SYNONYM)— chebi
4-Hydroxy-3-methoxycinnamaldehyde (EXACT_SYNONYM)— chebi
4-hydroxy-3-methoxycinnamaldehyde (EXACT_SYNONYM)— chebi
Coniferaldehyde (EXACT_SYNONYM)— chebi
Coniferyl aldehyde (EXACT_SYNONYM)— chebi
Ferulaldehyde (EXACT_SYNONYM)— chebi
(E)-coniferaldehyde (RELATED_SYNONYM)— chebi

Cross-references

Equivalent identifiers for this same structure in other resources.

cas:458-36-6
kegg.compound:C02666
knapsack:C00002728
metacyc.compound:CONIFERYL-ALDEHYDE
reaxys:2048208
wikipedia.en:Coniferyl_aldehyde

Activity roles

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

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:16547`	coniferyl aldehyde	`antibioticmech:chebi-b09d9ac6dd`	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.