U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry MIXED
Molecular Formula C33H53NO3
Molecular Weight 511.7788
Optical Activity UNSPECIFIED
Defined Stereocenters 0 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of NABOCTATE

SMILES

CCCCCCCC(C)C1=CC2=C(C(OC(=O)CCCN(CC)CC)=C1)C3=C(CCC(C)C3)C(C)(C)O2

InChI

InChIKey=UDQAWRWPAGUCRX-UHFFFAOYSA-N
InChI=1S/C33H53NO3/c1-8-11-12-13-14-16-25(5)26-22-29(36-31(35)17-15-20-34(9-2)10-3)32-27-21-24(4)18-19-28(27)33(6,7)37-30(32)23-26/h22-25H,8-21H2,1-7H3

HIDE SMILES / InChI
Naboctate (SP-325) is a synthetic cannabinoid receptor agonist, which has antiemetic, sedative, anxiolytic and anti-glaucoma properties. In a normotensive rabbit model, topically applied naboctate in aqueous solution induced dose-related decreases in intraocular pressure.

Approval Year

Sample Use Guides

In Vivo Use Guide
Sources: Cannabinoids: Chem., Pharmacol., Ther. Aspects, [Pap. Meet.] (1984), Meeting Date1982, 881-90.
aq. soln. 0.2, 0.5, and 1​%
Route of Administration: Topical
Name Type Language
NABOCTATE
INN  
INN  
Official Name English
(±)-7,8,9,10-TETRAHYDRO-6,6,9-TRIMETHYL-3-(1-METHYLOCTYL)6H-DIBENZO(B,D)PYRAN-1-YL 4-(DIETHYLAMINO)BUTYRATE
Systematic Name English
naboctate [INN]
Common Name English
BUTANOIC ACID, 4-(DIETHYLAMINO)-, 7,8,9,10-TETRAHYDRO-6,6,9-TRIMETHYL-3-(1-METHYLOCTYL)-6H-DIBENZO(B,D)PYRAN-1-YL ESTER, (±)-
Common Name English
Code System Code Type Description
FDA UNII
N6YFU80HRG
Created by admin on Fri Dec 15 17:12:11 GMT 2023 , Edited by admin on Fri Dec 15 17:12:11 GMT 2023
PRIMARY
SMS_ID
100000084426
Created by admin on Fri Dec 15 17:12:11 GMT 2023 , Edited by admin on Fri Dec 15 17:12:11 GMT 2023
PRIMARY
CAS
74912-19-9
Created by admin on Fri Dec 15 17:12:11 GMT 2023 , Edited by admin on Fri Dec 15 17:12:11 GMT 2023
PRIMARY
INN
5001
Created by admin on Fri Dec 15 17:12:11 GMT 2023 , Edited by admin on Fri Dec 15 17:12:11 GMT 2023
PRIMARY
WIKIPEDIA
NABOCTATE
Created by admin on Fri Dec 15 17:12:11 GMT 2023 , Edited by admin on Fri Dec 15 17:12:11 GMT 2023
PRIMARY
ChEMBL
CHEMBL2106848
Created by admin on Fri Dec 15 17:12:11 GMT 2023 , Edited by admin on Fri Dec 15 17:12:11 GMT 2023
PRIMARY
EPA CompTox
DTXSID401024546
Created by admin on Fri Dec 15 17:12:11 GMT 2023 , Edited by admin on Fri Dec 15 17:12:11 GMT 2023
PRIMARY
EVMPD
SUB09106MIG
Created by admin on Fri Dec 15 17:12:11 GMT 2023 , Edited by admin on Fri Dec 15 17:12:11 GMT 2023
PRIMARY
NCI_THESAURUS
C174745
Created by admin on Fri Dec 15 17:12:11 GMT 2023 , Edited by admin on Fri Dec 15 17:12:11 GMT 2023
PRIMARY
PUBCHEM
52339
Created by admin on Fri Dec 15 17:12:11 GMT 2023 , Edited by admin on Fri Dec 15 17:12:11 GMT 2023
PRIMARY