TREPRESTINIL METHYL ESTER

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C24H36O5
Molecular Weight	404.5396
Optical Activity	UNSPECIFIED
Defined Stereocenters	5 / 5
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

[H][C@]12C[C@@H](O)[C@H](CC[C@@H](O)CCCCC)[C@@]1([H])CC3=CC=CC(OCC(=O)OC)=C3C2

InChI

InChIKey=AMLGYPBESXMWIK-SXFAUFNYSA-N

InChI=1S/C24H36O5/c1-3-4-5-8-18(25)10-11-19-20-12-16-7-6-9-23(29-15-24(27)28-2)21(16)13-17(20)14-22(19)26/h6-7,9,17-20,22,25-26H,3-5,8,10-15H2,1-2H3/t17-,18-,19+,20-,22+/m0/s1

HIDE SMILES / InChI

Molecular Formula	C24H36O5
Molecular Weight	404.5396
Charge	0
Count

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

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 18:20:31 GMT 2023` Edited by `admin` on `Sat Dec 16 18:20:31 GMT 2023`
Record UNII	67K59PC7YH
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

TREPRESTINIL METHYL ESTER

Common Name

English

ACETIC ACID, 2-(((1R,2R,3AS,9AS)-2,3,3A,4,9,9A-HEXAHYDRO-2-HYDROXY-1-((3S)-3-HYDROXYOCTYL)-1H-BENZ(F)INDEN-5-YL)OXY)-, METHYL ESTER

Systematic Name

English

Code System Code Type Description

PUBCHEM

59733180

Created by admin on Sat Dec 16 18:20:31 GMT 2023 , Edited by admin on Sat Dec 16 18:20:31 GMT 2023

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CAS

81845-98-9

Created by admin on Sat Dec 16 18:20:31 GMT 2023 , Edited by admin on Sat Dec 16 18:20:31 GMT 2023

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FDA UNII

67K59PC7YH

Created by admin on Sat Dec 16 18:20:31 GMT 2023 , Edited by admin on Sat Dec 16 18:20:31 GMT 2023

PRIMARY

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