ACLIMOSTAT

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C26H42N2O6
Molecular Weight	478.6215
Optical Activity	UNSPECIFIED
Defined Stereocenters	6 / 6
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

[H][C@@]1([C@H](OC)[C@@H](CC[C@]12CO2)OC(=O)N3CC(CCN4CCOCC4)C3)[C@@]5(C)O[C@@H]5CC=C(C)C

InChI

InChIKey=QJWJPMLDQYEPPW-AUKZVGPFSA-N

InChI=1S/C26H42N2O6/c1-18(2)5-6-21-25(3,34-21)23-22(30-4)20(7-9-26(23)17-32-26)33-24(29)28-15-19(16-28)8-10-27-11-13-31-14-12-27/h5,19-23H,6-17H2,1-4H3/t20-,21-,22-,23-,25+,26+/m1/s1

HIDE SMILES / InChI

Molecular Formula	C26H42N2O6
Molecular Weight	478.6215
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	5 / 6
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 14:52:52 GMT 2023` Edited by `admin` on `Sat Dec 16 14:52:52 GMT 2023`
Record UNII	X150A3JK8R
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

ACLIMOSTAT

Official Name

English

(3R,4S,5S,6R)5METHOXY4((2R,3R)2METHYL3(3METHYLBUT2EN1YL)OXIRAN2YL)1OXASPIRO(2.5)OCTAN6YL 3(2(MORPHOLIN4YL)ETHYL)AZETIDINE1CARBOXYLATE

Systematic Name

English

(3R,4S,5S,6R)-5-METHOXY-4-((2R,3R)-2-METHYL-3-(3-METHYLBUT-2-EN-1-YL)OXIRAN-2-YL)-1-OXASPIRO(2.5)OCTAN-6-YL 3-(2-(MORPHOLIN-4-YL)ETHYL)AZETIDINE-1-CARBOXYLATE

Systematic Name

English

Aclimostat [WHO-DD]

Common Name

English

aclimostat [INN]

Common Name

English

ZGN-1061

Code

English

1-AZETIDINECARBOXYLIC ACID, 3-(2-(4-MORPHOLINYL)ETHYL)-, (3R,4S,5S,6R)-5-METHOXY-4-((2R,3R)-2-METHYL-3-(3-METHYL-2-BUTEN-1-YL)-2-OXIRANYL)-1-OXASPIRO(2.5)OCT-6-YL ESTER

Systematic Name

English

Code System Code Type Description

PUBCHEM

126573394