7-hydroxy-5-hydroxymethyl-2H-benzo[1,4]thiazin-3-one

CHEBI:66030 ·resolve ·ANTIBACTERIAL ·EXACT SEEDED

A benzothiazine that is 2H-1,4-benzothiazin-3(4H)-one substituted by a hydroxy and a hydroxymethyl group at positions 7 and 5 respectively. It is an antibacterial agent from Ampelomyces. — 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:22743 CHEBI:22743
CHEBI:24995 CHEBI:24995
CHEBI:33853 CHEBI:33853
CHEBI:46899 CHEBI:46899

Chemical structure

Computed structure properties
Molecular formula	C9H9NO3S
Charge	0
Average mass	211.242 Da
Monoisotopic mass	211.03031 Da
Source	ChEBI
InChIKey	CZXYFHNORNVRJZ-UHFFFAOYSA-N

SMILES

O=C1CSc2cc(O)cc(CO)c2N1

InChI

InChI=1S/C9H9NO3S/c11-3-5-1-6(12)2-7-9(5)10-8(13)4-14-7/h1-2,11-12H,3-4H2,(H,10,13)

Also called

7-hydroxy-5-(hydroxymethyl)-2H-1,4-benzothiazin-3(4H)-one (EXACT_SYNONYM)— chebi

Cross-references

Equivalent identifiers for this same structure in other resources.

reaxys:18590033

Activity roles

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

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:66030`	7-hydroxy-5-hydroxymethyl-2H-benzo[1,4]thiazin-3-one	`antibioticmech:chebi-1b90a10ed1`	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.