LUPROSTIOL , (1S,2R,3R,5S)-(2S)-

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C21H29ClO6S
Molecular Weight	444.969
Optical Activity	UNSPECIFIED
Defined Stereocenters	5 / 5
E/Z Centers	1
Charge	0

SHOW SMILES / InChI

Structure of LUPROSTIOL , (1S,2R,3R,5S)-(2S)-

Structure Search

SMILES

O[C@@H](COC1=CC=CC(Cl)=C1)CS[C@H]2[C@H](O)C[C@H](O)[C@@H]2C\C=C/CCCC(O)=O

InChI

InChIKey=KFUDFIMHDRJVLV-MSKGSUGCSA-N

InChI=1S/C21H29ClO6S/c22-14-6-5-7-16(10-14)28-12-15(23)13-29-21-17(18(24)11-19(21)25)8-3-1-2-4-9-20(26)27/h1,3,5-7,10,15,17-19,21,23-25H,2,4,8-9,11-13H2,(H,26,27)/b3-1-/t15-,17-,18-,19+,21+/m0/s1

HIDE SMILES / InChI

Molecular Formula	C21H29ClO6S
Molecular Weight	444.969
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	5 / 5
E/Z Centers	1
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 10:59:07 GMT 2023` Edited by `admin` on `Sat Dec 16 10:59:07 GMT 2023`
Record UNII	81EN2TEX9P
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

LUPROSTIOL , (1S,2R,3R,5S)-(2S)-

Common Name

English

7-((1S,2R,3R,5S)-2-(((2S)-3-(3-CHLOROPHENOXY)-2-HYDROXYPROPYL)THIO)-3,5-DIHYDROXYCYCLOPENTYL)-5-HEPTENOIC ACID, (5Z)-

Systematic Name

English

(5Z)-7-((1S,2R,3R,5S)-2-(((2S)-3-(3-CHLOROPHENOXY)-2-HYDROXYPROPYL)THIO)-3,5-DIHYDROXYCYCLOPENTYL)-5-HEPTENOIC ACID

Systematic Name

English

5-HEPTENOIC ACID, 7-(2-((3-(3-CHLOROPHENOXY)-2-HYDROXYPROPYL)THIO)-3,5-DIHYDROXYCYCLOPENTYL)-, (1S-(1.ALPHA.(Z),2.BETA.(S*),3.ALPHA.,5.ALPHA.))-

Systematic Name

English

5-HEPTENOIC ACID, 7-((1S,2R,3R,5S)-2-(((2S)-3-(3-CHLOROPHENOXY)-2-HYDROXYPROPYL)THIO)-3,5-DIHYDROXYCYCLOPENTYL)-, (5Z)-

Systematic Name

English

Code System Code Type Description

FDA UNII

81EN2TEX9P

Created by admin on Sat Dec 16 10:59:07 GMT 2023 , Edited by admin on Sat Dec 16 10:59:07 GMT 2023

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CAS

73523-01-0

Created by admin on Sat Dec 16 10:59:07 GMT 2023 , Edited by admin on Sat Dec 16 10:59:07 GMT 2023

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PUBCHEM

6438715

Created by admin on Sat Dec 16 10:59:07 GMT 2023 , Edited by admin on Sat Dec 16 10:59:07 GMT 2023

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