5α-cholesta-24-en-3β,20β-diol-23-one

CHEBI:228296 ·resolve ·ANTIBACTERIAL ·EXACT SEEDED

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:131619 CHEBI:131619
CHEBI:228297 CHEBI:228297
CHEBI:36836 CHEBI:36836
CHEBI:36854 CHEBI:36854

Chemical structure

Computed structure properties
Molecular formula	C27H44O3
Charge	0
Average mass	416.646 Da
Monoisotopic mass	416.32905 Da
Source	ChEBI
InChIKey	JLSGWGFUNKKVBT-FMDNSJKISA-N

SMILES

CC(C)=CC(=O)C[C@](C)(O)C1CCC2C3CCC4C[C@@H](O)CC[C@]4(C)C3CC[C@@]21C

InChI

InChI=1S/C27H44O3/c1-17(2)14-20(29)16-27(5,30)24-9-8-22-21-7-6-18-15-19(28)10-12-25(18,3)23(21)11-13-26(22,24)4/h14,18-19,21-24,28,30H,6-13,15-16H2,1-5H3/t18?,19-,21?,22?,23?,24?,25-,26-,27-/m0/s1

Also called

(9ξ,14ξ)-3β,20-dihydroxy-8ξ,17ξ-cholest-24-en-23-one (EXACT_SYNONYM)— chebi

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:228296`	5α-cholesta-24-en-3β,20β-diol-23-one	`antibioticmech:chebi-f5a257d63e`	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.