NABITAN HYDROCHLORIDE

Details

Stereochemistry	MIXED
Molecular Formula	C35H52N2O3.ClH
Molecular Weight	585.26
Optical Activity	UNSPECIFIED
Defined Stereocenters	0 / 2
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

Cl.CCCCCC(C)C(C)C1=CC2=C(C(OC(=O)CCCN3CCCCC3)=C1)C4=C(CCN(CC#C)C4)C(C)(C)O2

InChI

InChIKey=KWXQFOPVLBPXHY-UHFFFAOYSA-N

InChI=1S/C35H52N2O3.ClH/c1-7-9-11-15-26(3)27(4)28-23-31(39-33(38)16-14-21-36-19-12-10-13-20-36)34-29-25-37(18-8-2)22-17-30(29)35(5,6)40-32(34)24-28;/h2,23-24,26-27H,7,9-22,25H2,1,3-6H3;1H

HIDE SMILES / InChI

Molecular Formula	C35H52N2O3
Molecular Weight	548.799
Charge	0
Count

Stereochemistry	MIXED
Additional Stereochemistry	No
Defined Stereocenters	0 / 2
E/Z Centers	0
Optical Activity	UNSPECIFIED

Molecular Formula	ClH
Molecular Weight	36.461
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Description
Sources: https://www.sciencedirect.com/science/article/pii/S0161642081350520?via%3Dihub | https://worldwide.espacenet.com/publicationDetails/biblio?DB=EPODOC&II=0&ND=3&adjacent=true&locale=en_EP&FT=D&date=20080417&CC=WO&NR=2008045556A2&KC=A2

Nabitan is a synthetic cannabinoid analog of dronabinol with antiemetic and analgesic effects. Nabitan is not currently used in medicine as dronabinol or nabilone are felt to be more useful for most conditions, however, it is sometimes used in research into the potential therapeutic applications of cannabinoids.

Originator

Approval Year

Patents

Substance Class	Chemical Created by `admin` on `Fri Dec 15 17:54:05 GMT 2023` Edited by `admin` on `Fri Dec 15 17:54:05 GMT 2023`
Record UNII	2F3L1A6VXE
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

NABITAN HYDROCHLORIDE

Official Name

English

8-(1,2-Dimethylheptyl)-1,3,4,5-tetrahydro-5,5-dimethyl-2-(2-propynyl)-2H-[1]benzopyrano[4,3-c]pyridin-10-yl 1-piperidinebutyrate monohydrochloride

Systematic Name

English

NABITAN HYDROCHLORIDE [USAN]

Common Name

English

SP-106

Code

English

NABUTAN HYDROCHLORIDE

Common Name

English

NIB

Code

English

1-PIPERIDINEBUTANOIC ACID, 8-(1,2-DIMETHYLHEPTYL)-1,3,4,5-TETRAHYDRO-5,5-DIMETHYL-2-(2-PROPYNYL)-2H-(1)BENZOPYRANO(4,3-C)PYRIDIN-10-YL ESTER MONOHYDROCHLORIDE-

Common Name

English

Code System Code Type Description

FDA UNII

2F3L1A6VXE