SKF-10,047 (CHEBI:228203)

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ChEBI Name	SKF-10,047

ChEBI ID	CHEBI:228203

Definition	An organic heterotricyclic compound that is metazocine in which the methyl group at the N-position is replaced by an allyl group.

Stars	This entity has been manually annotated by the ChEBI Team.

Submitter	Kalpana P

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Formula

C17H23NO

Net Charge

Average Mass

257.377

Monoisotopic Mass

257.17796

InChI

InChI=1S/C17H23NO/c1-4-8-18-9-7-17(3)12(2)16(18)10-13-5-6-14(19)11-15(13)17/h4-6,11-12,16,19H,1,7-10H2,2-3H3

InChIKey

LGQCVMYAEFTEFN-UHFFFAOYSA-N

SMILES

CC1C2CC3=C(C=C(O)C=C3)C1(C)CCN2CC=C

Roles Classification
Chemical Role(s):	Bronsted base A molecular entity capable of accepting a hydron from a donor (Bronsted acid). (via organic amino compound )

Biological Role(s):	opioid analgesic A narcotic or opioid substance, synthetic or semisynthetic agent producing profound analgesia, drowsiness, and changes in mood. opioid receptor antagonist An agent that binds to but does not activate an opioid receptor thereby blocking the actions of endogenous or exogenous opioid receptor agonists.

Application(s):	opioid analgesic A narcotic or opioid substance, synthetic or semisynthetic agent producing profound analgesia, drowsiness, and changes in mood. opioid receptor antagonist An agent that binds to but does not activate an opioid receptor thereby blocking the actions of endogenous or exogenous opioid receptor agonists.

ChEBI Ontology
Outgoing	SKF-10,047 (CHEBI:228203) has role opioid analgesic (CHEBI:35482) SKF-10,047 (CHEBI:228203) has role opioid receptor antagonist (CHEBI:60605) SKF-10,047 (CHEBI:228203) is a olefinic compound (CHEBI:78840) SKF-10,047 (CHEBI:228203) is a organic heterotricyclic compound (CHEBI:26979) SKF-10,047 (CHEBI:228203) is a organic hydroxy compound (CHEBI:33822) SKF-10,047 (CHEBI:228203) is a tertiary amino compound (CHEBI:50996)

Incoming	(−)-SKF-10,047 (CHEBI:228224) is a SKF-10,047 (CHEBI:228203) (+)-SKF-10,047 (CHEBI:228223) is a SKF-10,047 (CHEBI:228203)

IUPAC Name

6,11-dimethyl-3-(prop-2-en-1-yl)-1,2,3,4,5,6-hexahydro-2,6-methano-3-benzazocin-8-ol

Registry Number	Type	Source
825594-24-9	CAS Registry Number	ChEBI

Last Modified

17 November 2023

General Comment
2023-11-15	This is the entry for material with unspecified stereochemistry. There are separate entries for the (+)- and (−)-SKF-10,047 isomers.