bacilysin

CHEBI:72687 ·resolve ·ANTIMICROBIAL_UNSPECIFIED ·EXACT SEEDED

A non-ribosomally synthesised dipeptide that consists of L-alanyl and anticapsin units linked by a peptide bond. — 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:25903 CHEBI:25903
CHEBI:32955 CHEBI:32955
CHEBI:36132 CHEBI:36132
CHEBI:46761 CHEBI:46761

Chemical structure

Computed structure properties
Molecular formula	C12H18N2O5
Charge	0
Average mass	270.285 Da
Monoisotopic mass	270.12157 Da
Source	ChEBI
InChIKey	XFOUAXMJRHNTOP-PFQXTLEHSA-N

SMILES

C[C@H](N)C(=O)N[C@@H](C[C@@H]1CCC(=O)[C@@H]2O[C@H]12)C(=O)O

InChI

InChI=1S/C12H18N2O5/c1-5(13)11(16)14-7(12(17)18)4-6-2-3-8(15)10-9(6)19-10/h5-7,9-10H,2-4,13H2,1H3,(H,14,16)(H,17,18)/t5-,6-,7-,9+,10-/m0/s1

Also called

L-alanyl-3-[(1R,2S,6R)-5-oxo-7-oxabicyclo[4.1.0]hept-2-yl]-L-alanine (EXACT_SYNONYM)— chebi
Antibiotic KM 208 (EXACT_SYNONYM)— chebi
N-L-Alanyl-3-(5-oxo-7-oxabicyclo(4.1.0)hept-2-yl)-L-alanine (EXACT_SYNONYM)— chebi
Tetaine (EXACT_SYNONYM)— chebi

Cross-references

Equivalent identifiers for this same structure in other resources.

cas:29393-20-2
patent:EP2179652
reaxys:6637452

Activity roles

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

CHEBI:33281 CHEBI:33281

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:72687`	bacilysin	`antibioticmech:chebi-b4e1fc3a12`	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.