Naltrexone ethylene ketal

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C22H27NO5
Molecular Weight	385.4535
Optical Activity	UNSPECIFIED
Defined Stereocenters	4 / 4
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

OC1=CC=C2C[C@H]3N(CC4CC4)CC[C@@]56[C@@H](OC1=C25)C7(CC[C@@]36O)OCCO7

InChI

InChIKey=LKLYAPXOLONEKI-RZXSNQJFSA-N

InChI=1S/C22H27NO5/c24-15-4-3-14-11-16-21(25)5-6-22(26-9-10-27-22)19-20(21,17(14)18(15)28-19)7-8-23(16)12-13-1-2-13/h3-4,13,16,19,24-25H,1-2,5-12H2/t16-,19-,20+,21-/m1/s1

HIDE SMILES / InChI

Molecular Formula	C22H27NO5
Molecular Weight	385.4535
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	4 / 4
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Wed Apr 02 19:13:52 GMT 2025` Edited by `admin` on `Wed Apr 02 19:13:52 GMT 2025`
Record UNII	ZR3N6PX8ZF
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

Naltrexone ethylene ketal

Common Name

English

(4'R,4'aS,7'aR,12'bS)-3'-(Cyclopropylmethyl)spiro[1,3-dioxolane-2,7'-2,4,5,6,7a,13-hexahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinoline]-4'a,9'-diol

Preferred Name

English

Morphinan-6-one, 17-(cyclopropylmethyl)-4,5-epoxy-3,14-dihydroxy-, cyclic 1,2-ethanediyl acetal, (5?)-

Systematic Name

English

Morphinan-6-one, 17-(cyclopropylmethyl)-4,5?-epoxy-3,14-dihydroxy-, cyclic ethylene acetal

Systematic Name

English

Code System Code Type Description

FDA UNII

ZR3N6PX8ZF

Created by admin on Wed Apr 02 19:13:52 GMT 2025 , Edited by admin on Wed Apr 02 19:13:52 GMT 2025

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PUBCHEM

15372454

Created by admin on Wed Apr 02 19:13:52 GMT 2025 , Edited by admin on Wed Apr 02 19:13:52 GMT 2025

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CAS

16676-32-7

Created by admin on Wed Apr 02 19:13:52 GMT 2025 , Edited by admin on Wed Apr 02 19:13:52 GMT 2025

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