17-dimethylaminolobohedleolide

CHEBI:66587 ·resolve ·ANTIVIRAL ·EXACT SEEDED

A cembrane diterpenoid isolated from Lobophytum and shown to have anti-HIV-1 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:25384 CHEBI:25384
CHEBI:32876 CHEBI:32876
CHEBI:37581 CHEBI:37581
CHEBI:60687 CHEBI:60687

Chemical structure

Computed structure properties
Molecular formula	C22H33NO4
Charge	0
Average mass	375.509 Da
Monoisotopic mass	375.24096 Da
Source	ChEBI
InChIKey	HRPBIJBOFQXOTL-JEJSWHNFSA-N

SMILES

[H][C@@]12CC/C(C)=C/CC/C(C(=O)O)=C/CC/C(C)=C/[C@]1([H])OC(=O)[C@H]2CN(C)C

InChI

InChI=1S/C22H33NO4/c1-15-7-5-9-17(21(24)25)10-6-8-16(2)13-20-18(12-11-15)19(14-23(3)4)22(26)27-20/h7,10,13,18-20H,5-6,8-9,11-12,14H2,1-4H3,(H,24,25)/b15-7+,16-13+,17-10-/t18-,19-,20-/m0/s1

Also called

(3R,3aS,6E,10E,14E,15aR)-3-[(dimethylamino)methyl]-6,14-dimethyl-2-oxo-2,3,3a,4,5,8,9,12,13,15a-decahydrocyclotetradeca[b]furan-10-carboxylic acid (EXACT_SYNONYM)— chebi

Cross-references

Equivalent identifiers for this same structure in other resources.

reaxys:8589733

Activity roles

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

CHEBI:64947 CHEBI:64947

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:66587`	17-dimethylaminolobohedleolide	`antibioticmech:chebi-316298efa5`	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.