caseargrewiin D

CHEBI:65595 ·resolve ·ANTIMYCOBACTERIAL ·EXACT SEEDED

A diterpenoid of the clerodane group isolated from the bark of Casearia grewiifolia and has been shown to exhibit antimalarial and antimycobacterial activity. — 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:23849 CHEBI:23849
CHEBI:26979 CHEBI:26979
CHEBI:35681 CHEBI:35681
CHEBI:37407 CHEBI:37407
CHEBI:47622 CHEBI:47622

Chemical structure

Computed structure properties
Molecular formula	C24H34O6
Charge	0
Average mass	418.53 Da
Monoisotopic mass	418.23554 Da
Source	ChEBI
InChIKey	CLMGAZWYZXAAJO-FURQXPDPSA-N

SMILES

[H][C@@]12C[C@@H](O)C=C3[C@@H](OC(C)=O)O[C@@H](OC(C)=O)[C@]31CC[C@@H](C)[C@@]2(C)C/C=C(/C)C=C

InChI

InChI=1S/C24H34O6/c1-7-14(2)8-10-23(6)15(3)9-11-24-19(12-18(27)13-20(23)24)21(28-16(4)25)30-22(24)29-17(5)26/h7-8,12,15,18,20-22,27H,1,9-11,13H2,2-6H3/b14-8-/t15-,18+,20+,21+,22-,23-,24-/m1/s1

Also called

(1S,3R,5R,6aS,7R,8R,10aS)-5-hydroxy-7,8-dimethyl-7-[(2Z)-3-methylpenta-2,4-dien-1-yl]-3,5,6,6a,7,8,9,10-octahydronaphtho[1,8a-c]furan-1,3-diyl diacetate (EXACT_SYNONYM)— chebi
(2R,5S,8R,9R,10S,18R,19S)-18,19-diacetoxy-18,19-epoxy-2-hydroxy-cleroda-3,12-(Z),14-triene (EXACT_SYNONYM)— chebi

Cross-references

Equivalent identifiers for this same structure in other resources.

reaxys:15803795

Activity roles

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

CHEBI:38068 CHEBI:38068
CHEBI:64912 CHEBI:64912

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:65595`	caseargrewiin D	`antibioticmech:chebi-16ca6d9b22`	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.