deoxylapachol

CHEBI:4414 ·resolve ·ANTIFUNGAL ·EXACT SEEDED

A member of the class of 1,4-naphthoquinones that is 1,4-naphthoquinone substituted by a 3-methylbut-2-en-1-yl group at position 2. — 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:132142 CHEBI:132142
CHEBI:78840 CHEBI:78840

Chemical structure

Computed structure properties
Molecular formula	C15H14O2
Charge	0
Average mass	226.275 Da
Monoisotopic mass	226.09938 Da
Source	ChEBI
InChIKey	OSDFYZPKJKRCRR-UHFFFAOYSA-N

SMILES

CC(C)=CCC1=CC(=O)c2ccccc2C1=O

InChI

InChI=1S/C15H14O2/c1-10(2)7-8-11-9-14(16)12-5-3-4-6-13(12)15(11)17/h3-7,9H,8H2,1-2H3

Also called

2-(3-methylbut-2-en-1-yl)naphthalene-1,4-dione (EXACT_SYNONYM)— chebi
2-(3-methyl-2-buten-1-yl)-1,4-naphthalenedione (EXACT_SYNONYM)— chebi
2-(3-methyl-2-butenyl)-1,4-naphthoquinone (EXACT_SYNONYM)— chebi
2-(3-methyl-2-butenyl)naphthalene-1,4-dione (EXACT_SYNONYM)— chebi
desoxylapachol (EXACT_SYNONYM)— chebi
3-prenyl-1,4-naphthoquinone (RELATED_SYNONYM)— chebi

Cross-references

Equivalent identifiers for this same structure in other resources.

cas:3568-90-9
kegg.compound:C10325
knapsack:C00002813

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:4414`	deoxylapachol	`antibioticmech:chebi-4467555563`	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.