Details of the Drug

General Information of Drug (ID: DMJBZC9)

Drug Name

ELEMENE

Synonyms

Cyclohexane, 1-ethenyl-1-methyl-2,4-bis(1-methylethenyl)-, (1R,2R,4S)-rel-; 33880-83-0; beta-Elemene, (-)-; (- )-bete-elemene; EINECS 251-713-0; AC1L1VID; Cyclohexane, 2,4-diisopropenyl-1-methyl-1-vinyl-, (1S,2S,4R)-; OPFTUNCRGUEPRZ-UHFFFAOYSA-N; Cyclohexane, 1-ethenyl-1-methyl-2,4-bis(1-methylethenyl)-, (1S-(1-alpha,2-beta,4-beta))-; (1alpha,2beta,4beta)-1-Methyl-2,4-bis(methylvinyl)-1-vinylcyclohexane; LS-56795; EN300-296339; 1-Methyl-1-vinyl-2,4-diisopropenylcyclohexane

Indication

Disease Entry	ICD 11	Status	REF
Solid tumour/cancer	2A00-2F9Z	Phase 1	[1]
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Drug Type

Small molecular drug

Structure

3D MOL

2D MOL

Chemical Identifiers

Formula: C15H24
Canonical SMILES: CC(=C)C1CCC(C(C1)C(=C)C)(C)C=C
InChI: 1S/C15H24/c1-7-15(6)9-8-13(11(2)3)10-14(15)12(4)5/h7,13-14H,1-2,4,8-10H2,3,5-6H3
InChIKey: OPFTUNCRGUEPRZ-UHFFFAOYSA-N

Cross-matching ID

PubChem CID: 10583
CAS Number: 33880-83-0
TTD ID: D04VMG

References

1	ClinicalTrials.gov (NCT01679847) Blood Brain Barrier Penetration and Pharmacokinetics of the Elemene in Malignant Patients.. U.S. National Institutes of Health.